WAY-298861
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1)
1

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>  <MolWeight> (1)
302.28206

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WAY-298861

>  <CNC_ID> (1)
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>  <COMPOUND_NUMBER> (1)
WAY-298861

>  <BAR_CODE_NO> (1)
3900464

>  <LOCATION_CODE> (1)
PTNCS

>  <AMOUNT_CURRENT> (1)
33.5

$$$$
WAY-298871
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2)
2

>  <Formula> (2)
C14H18N2O3

>  <MolWeight> (2)
262.30432

>  <PCAT_CMPD_ID> (2)
WAY-298871

>  <CNC_ID> (2)
359357865

>  <transfer_container_id> (2)
PTN000000069

>  <COMPOUND_NUMBER> (2)
WAY-298871

>  <BAR_CODE_NO> (2)
3900478

>  <LOCATION_CODE> (2)
PTNCS

>  <AMOUNT_CURRENT> (2)
33.5

$$$$
WAY-298903
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (3)
3

>  <Formula> (3)
C20H21FN2O4S

>  <MolWeight> (3)
404.4551432

>  <PCAT_CMPD_ID> (3)
WAY-298903

>  <CNC_ID> (3)
359357897

>  <transfer_container_id> (3)
PTN000000069

>  <COMPOUND_NUMBER> (3)
WAY-298903

>  <BAR_CODE_NO> (3)
3900521

>  <LOCATION_CODE> (3)
PTNCS

>  <AMOUNT_CURRENT> (3)
33.2

$$$$
WAY-298910
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (4)
4

>  <Formula> (4)
C13H15ClN2OS

>  <MolWeight> (4)
282.789

>  <PCAT_CMPD_ID> (4)
WAY-298910

>  <CNC_ID> (4)
359357904

>  <transfer_container_id> (4)
PTN000000069

>  <COMPOUND_NUMBER> (4)
WAY-298910

>  <BAR_CODE_NO> (4)
3900530

>  <LOCATION_CODE> (4)
PTNCS

>  <AMOUNT_CURRENT> (4)
33.1

$$$$
WAY-298944-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (5)
5

>  <Formula> (5)
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>  <MolWeight> (5)
292.3369

>  <PCAT_CMPD_ID> (5)
WAY-298944-A

>  <CNC_ID> (5)
359357938

>  <transfer_container_id> (5)
PTN000000069

>  <COMPOUND_NUMBER> (5)
WAY-298944-A

>  <BAR_CODE_NO> (5)
3900580

>  <LOCATION_CODE> (5)
PTNCS

>  <AMOUNT_CURRENT> (5)
33.2

$$$$
WAY-298968
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (6)
6

>  <Formula> (6)
C16H13F3N2O3S

>  <MolWeight> (6)
370.3462296

>  <PCAT_CMPD_ID> (6)
WAY-298968

>  <CNC_ID> (6)
359357962

>  <transfer_container_id> (6)
PTN000000069

>  <COMPOUND_NUMBER> (6)
WAY-298968

>  <BAR_CODE_NO> (6)
3900608

>  <LOCATION_CODE> (6)
PTNCS

>  <AMOUNT_CURRENT> (6)
33.3

$$$$
WAY-299017
csChFnd80/10111816222D

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 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
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 20 22  2  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (7)
7

>  <Formula> (7)
C17H14N2O3

>  <MolWeight> (7)
294.30466

>  <PCAT_CMPD_ID> (7)
WAY-299017

>  <CNC_ID> (7)
359358011

>  <transfer_container_id> (7)
PTN000000069

>  <COMPOUND_NUMBER> (7)
WAY-299017

>  <BAR_CODE_NO> (7)
3900676

>  <LOCATION_CODE> (7)
PTNCS

>  <AMOUNT_CURRENT> (7)
33.1

$$$$
WAY-299392
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
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 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
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 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
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 14 15  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (8)
8

>  <Formula> (8)
C20H14BrNO3

>  <MolWeight> (8)
396.23406

>  <PCAT_CMPD_ID> (8)
WAY-299392

>  <CNC_ID> (8)
359358386

>  <transfer_container_id> (8)
PTN000000069

>  <COMPOUND_NUMBER> (8)
WAY-299392

>  <BAR_CODE_NO> (8)
3901169

>  <LOCATION_CODE> (8)
PTNCS

>  <AMOUNT_CURRENT> (8)
33.1

$$$$
WAY-299487
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 23 25  2  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (9)
9

>  <Formula> (9)
C18H15F3N4O4

>  <MolWeight> (9)
408.3313096

>  <PCAT_CMPD_ID> (9)
WAY-299487

>  <CNC_ID> (9)
359358481

>  <transfer_container_id> (9)
PTN000000069

>  <COMPOUND_NUMBER> (9)
WAY-299487

>  <BAR_CODE_NO> (9)
3901285

>  <LOCATION_CODE> (9)
PTNCS

>  <AMOUNT_CURRENT> (9)
33.4

$$$$
WAY-299490
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (10)
10

>  <Formula> (10)
C10H10N4OS2

>  <MolWeight> (10)
266.3426

>  <PCAT_CMPD_ID> (10)
WAY-299490

>  <CNC_ID> (10)
359358484

>  <transfer_container_id> (10)
PTN000000069

>  <COMPOUND_NUMBER> (10)
WAY-299490

>  <BAR_CODE_NO> (10)
3901292

>  <LOCATION_CODE> (10)
PTNCS

>  <AMOUNT_CURRENT> (10)
33.4

$$$$
WAY-299491
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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M  END
>  <Mol_ID> (11)
11

>  <Formula> (11)
C10H9N5S2

>  <MolWeight> (11)
263.34196

>  <PCAT_CMPD_ID> (11)
WAY-299491

>  <CNC_ID> (11)
359358485

>  <transfer_container_id> (11)
PTN000000069

>  <COMPOUND_NUMBER> (11)
WAY-299491

>  <BAR_CODE_NO> (11)
3901293

>  <LOCATION_CODE> (11)
PTNCS

>  <AMOUNT_CURRENT> (11)
33.3

$$$$
WAY-299504-A
csChFnd80/10111816222D

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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (12)
12

>  <Formula> (12)
C18H25NO3

>  <MolWeight> (12)
303.396

>  <PCAT_CMPD_ID> (12)
WAY-299504-A

>  <CNC_ID> (12)
359358498

>  <transfer_container_id> (12)
PTN000000069

>  <COMPOUND_NUMBER> (12)
WAY-299504-A

>  <BAR_CODE_NO> (12)
3901311

>  <LOCATION_CODE> (12)
PTNCS

>  <AMOUNT_CURRENT> (12)
33.4

$$$$
WAY-299539
csChFnd80/10111816222D

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 21 25  2  0  0  0  0
 24 27  1  0  0  0  0
M  END
>  <Mol_ID> (13)
13

>  <Formula> (13)
C21H18FNO5

>  <MolWeight> (13)
383.3697232

>  <PCAT_CMPD_ID> (13)
WAY-299539

>  <CNC_ID> (13)
359358533

>  <transfer_container_id> (13)
PTN000000069

>  <COMPOUND_NUMBER> (13)
WAY-299539

>  <BAR_CODE_NO> (13)
3901356

>  <LOCATION_CODE> (13)
PTNCS

>  <AMOUNT_CURRENT> (13)
33

$$$$
WAY-299542
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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M  END
>  <Mol_ID> (14)
14

>  <Formula> (14)
C19H16N4OS

>  <MolWeight> (14)
348.42154

>  <PCAT_CMPD_ID> (14)
WAY-299542

>  <CNC_ID> (14)
359358536

>  <transfer_container_id> (14)
PTN000000069

>  <COMPOUND_NUMBER> (14)
WAY-299542

>  <BAR_CODE_NO> (14)
3901359

>  <LOCATION_CODE> (14)
PTNCS

>  <AMOUNT_CURRENT> (14)
33.5

$$$$
WAY-299548
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  2  7  2  0  0  0  0
 15  9  2  0  0  0  0
M  END
>  <Mol_ID> (15)
15

>  <Formula> (15)
C15H16N2O4

>  <MolWeight> (15)
288.29854

>  <PCAT_CMPD_ID> (15)
WAY-299548

>  <CNC_ID> (15)
359358543

>  <transfer_container_id> (15)
PTN000000069

>  <COMPOUND_NUMBER> (15)
WAY-299548

>  <BAR_CODE_NO> (15)
3901368

>  <LOCATION_CODE> (15)
PTNCS

>  <AMOUNT_CURRENT> (15)
33.3

$$$$
WAY-321523
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (16)
16

>  <Formula> (16)
C21H20N2O2S2

>  <MolWeight> (16)
396.5257

>  <PCAT_CMPD_ID> (16)
WAY-321523

>  <CNC_ID> (16)
359358546

>  <transfer_container_id> (16)
PTN000000069

>  <COMPOUND_NUMBER> (16)
WAY-321523

>  <BAR_CODE_NO> (16)
2540219

>  <LOCATION_CODE> (16)
PTNCS

>  <AMOUNT_CURRENT> (16)
32.2

$$$$
WAY-321676
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 10 19  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13 10  1  0  0  0  0
 14  2  2  0  0  0  0
 15  3  1  0  0  0  0
 16  3  1  0  0  0  0
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 20  4  2  0  0  0  0
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 22  8  1  0  0  0  0
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 23  9  2  0  0  0  0
 27 30  1  0  0  0  0
M  END
>  <Mol_ID> (17)
17

>  <Formula> (17)
C22H21N3O4S

>  <MolWeight> (17)
423.48484

>  <PCAT_CMPD_ID> (17)
WAY-321676

>  <CNC_ID> (17)
359358547

>  <transfer_container_id> (17)
PTN000000069

>  <COMPOUND_NUMBER> (17)
WAY-321676

>  <BAR_CODE_NO> (17)
2540210

>  <LOCATION_CODE> (17)
PTNCS

>  <AMOUNT_CURRENT> (17)
32.9

$$$$
WAY-322454
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  1  1  0  0  0  0
 12  8  2  0  0  0  0
 13  4  1  0  0  0  0
 14  8  1  0  0  0  0
 15 10  2  0  0  0  0
 16  9  2  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
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 23 15  1  0  0  0  0
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (18)
18

>  <Formula> (18)
C17H20N4O2

>  <MolWeight> (18)
312.3663

>  <PCAT_CMPD_ID> (18)
WAY-322454

>  <CNC_ID> (18)
359358549

>  <transfer_container_id> (18)
PTN000000069

>  <COMPOUND_NUMBER> (18)
WAY-322454

>  <BAR_CODE_NO> (18)
2540406

>  <LOCATION_CODE> (18)
PTNCS

>  <AMOUNT_CURRENT> (18)
32.8

$$$$
WAY-322476
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
 12  4  1  0  0  0  0
 13  3  1  0  0  0  0
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 10  6  1  0  0  0  0
 14 21  1  0  0  0  0
M  END
>  <Mol_ID> (19)
19

>  <Formula> (19)
C16H17N5

>  <MolWeight> (19)
279.33968

>  <PCAT_CMPD_ID> (19)
WAY-322476

>  <CNC_ID> (19)
359358551

>  <transfer_container_id> (19)
PTN000000069

>  <COMPOUND_NUMBER> (19)
WAY-322476

>  <BAR_CODE_NO> (19)
2540066

>  <LOCATION_CODE> (19)
PTNCS

>  <AMOUNT_CURRENT> (19)
32.1

$$$$
WAY-325090
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  7  1  0  0  0  0
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 14  5  1  0  0  0  0
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M  END
>  <Mol_ID> (20)
20

>  <Formula> (20)
C19H15N3O2S2

>  <MolWeight> (20)
381.4713

>  <PCAT_CMPD_ID> (20)
WAY-325090

>  <CNC_ID> (20)
359358555

>  <transfer_container_id> (20)
PTN000000069

>  <COMPOUND_NUMBER> (20)
WAY-325090

>  <BAR_CODE_NO> (20)
2540217

>  <LOCATION_CODE> (20)
PTNCS

>  <AMOUNT_CURRENT> (20)
32.2

$$$$
WAY-382509
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  8  2  0  0  0  0
 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
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 17 12  2  0  0  0  0
 18 13  1  0  0  0  0
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 20 14  2  0  0  0  0
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  5  2  1  0  0  0  0
 21 15  2  0  0  0  0
 22 26  1  0  0  0  0
 24 27  1  0  0  0  0
M  END
>  <Mol_ID> (21)
21

>  <Formula> (21)
C22H17N3O2

>  <MolWeight> (21)
355.38928

>  <PCAT_CMPD_ID> (21)
WAY-382509

>  <CNC_ID> (21)
359360673

>  <transfer_container_id> (21)
PTN000000069

>  <COMPOUND_NUMBER> (21)
WAY-382509

>  <BAR_CODE_NO> (21)
2540002

>  <LOCATION_CODE> (21)
PTNCS

>  <AMOUNT_CURRENT> (21)
29.6

$$$$
WAY-382520
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
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 22 24  2  0  0  0  0
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  5  7  1  0  0  0  0
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 17 18  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (22)
22

>  <Formula> (22)
C21H14N2O2S

>  <MolWeight> (22)
358.41306

>  <PCAT_CMPD_ID> (22)
WAY-382520

>  <CNC_ID> (22)
359360684

>  <transfer_container_id> (22)
PTN000000069

>  <COMPOUND_NUMBER> (22)
WAY-382520

>  <BAR_CODE_NO> (22)
2540018

>  <LOCATION_CODE> (22)
PTNCS

>  <AMOUNT_CURRENT> (22)
32.6

$$$$
WAY-382523
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  2  2  0  0  0  0
 12  4  1  0  0  0  0
 13  7  2  0  0  0  0
 14  9  1  0  0  0  0
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 16  8  2  0  0  0  0
 17  6  2  0  0  0  0
 18  5  2  0  0  0  0
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 16 27  1  0  0  0  0
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 32 33  2  0  0  0  0
 19 28  1  0  0  0  0
M  END
>  <Mol_ID> (23)
23

>  <Formula> (23)
C27H20N2O4

>  <MolWeight> (23)
436.4587

>  <PCAT_CMPD_ID> (23)
WAY-382523

>  <CNC_ID> (23)
359360687

>  <transfer_container_id> (23)
PTN000000069

>  <COMPOUND_NUMBER> (23)
WAY-382523

>  <BAR_CODE_NO> (23)
2540021

>  <LOCATION_CODE> (23)
PTNCS

>  <AMOUNT_CURRENT> (23)
32.2

$$$$
WAY-382537
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
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 20 21  2  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (24)
24

>  <Formula> (24)
C20H21N3O4S2

>  <MolWeight> (24)
431.52844

>  <PCAT_CMPD_ID> (24)
WAY-382537

>  <CNC_ID> (24)
359360701

>  <transfer_container_id> (24)
PTN000000069

>  <COMPOUND_NUMBER> (24)
WAY-382537

>  <BAR_CODE_NO> (24)
2540034

>  <LOCATION_CODE> (24)
PTNCS

>  <AMOUNT_CURRENT> (24)
32.8

$$$$
WAY-382557-A
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (25)
25

>  <Formula> (25)
C15H24NO2+

>  <MolWeight> (25)
250.35656

>  <PCAT_CMPD_ID> (25)
WAY-382557-A

>  <CNC_ID> (25)
359360721

>  <transfer_container_id> (25)
PTN000000069

>  <COMPOUND_NUMBER> (25)
WAY-382557-A

>  <BAR_CODE_NO> (25)
2540054

>  <LOCATION_CODE> (25)
PTNCS

>  <AMOUNT_CURRENT> (25)
32.5

$$$$
WAY-382562
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (26)
26

>  <Formula> (26)
C20H20N4O3S

>  <MolWeight> (26)
396.4628

>  <PCAT_CMPD_ID> (26)
WAY-382562

>  <CNC_ID> (26)
359360726

>  <transfer_container_id> (26)
PTN000000069

>  <COMPOUND_NUMBER> (26)
WAY-382562

>  <BAR_CODE_NO> (26)
2540062

>  <LOCATION_CODE> (26)
PTNCS

>  <AMOUNT_CURRENT> (26)
32.2

$$$$
WAY-382571
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (27)
27

>  <Formula> (27)
C14H12N2S

>  <MolWeight> (27)
240.32348

>  <PCAT_CMPD_ID> (27)
WAY-382571

>  <CNC_ID> (27)
359360734

>  <transfer_container_id> (27)
PTN000000069

>  <COMPOUND_NUMBER> (27)
WAY-382571

>  <BAR_CODE_NO> (27)
2540071

>  <LOCATION_CODE> (27)
PTNCS

>  <AMOUNT_CURRENT> (27)
32.5

$$$$
WAY-382598
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (28)
28

>  <Formula> (28)
C25H30N2O3S2

>  <MolWeight> (28)
470.6473

>  <PCAT_CMPD_ID> (28)
WAY-382598

>  <CNC_ID> (28)
359360759

>  <transfer_container_id> (28)
PTN000000069

>  <COMPOUND_NUMBER> (28)
WAY-382598

>  <BAR_CODE_NO> (28)
2540099

>  <LOCATION_CODE> (28)
PTNCS

>  <AMOUNT_CURRENT> (28)
32.8

$$$$
WAY-382603-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (29)
29

>  <Formula> (29)
C21H21N5S

>  <MolWeight> (29)
375.48994

>  <PCAT_CMPD_ID> (29)
WAY-382603-A

>  <CNC_ID> (29)
359360764

>  <transfer_container_id> (29)
PTN000000069

>  <COMPOUND_NUMBER> (29)
WAY-382603-A

>  <BAR_CODE_NO> (29)
2540106

>  <LOCATION_CODE> (29)
PTNCS

>  <AMOUNT_CURRENT> (29)
32.1

$$$$
WAY-382617
csChFnd80/10111816222D

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 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (30)
30

>  <Formula> (30)
C12H12N2OS

>  <MolWeight> (30)
232.30148

>  <PCAT_CMPD_ID> (30)
WAY-382617

>  <CNC_ID> (30)
359360778

>  <transfer_container_id> (30)
PTN000000069

>  <COMPOUND_NUMBER> (30)
WAY-382617

>  <BAR_CODE_NO> (30)
2540125

>  <LOCATION_CODE> (30)
PTNCS

>  <AMOUNT_CURRENT> (30)
18.9

$$$$
WAY-382620
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
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 16 18  2  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (31)
31

>  <Formula> (31)
C19H11ClN2O3S

>  <MolWeight> (31)
382.82024

>  <PCAT_CMPD_ID> (31)
WAY-382620

>  <CNC_ID> (31)
359360781

>  <transfer_container_id> (31)
PTN000000069

>  <COMPOUND_NUMBER> (31)
WAY-382620

>  <BAR_CODE_NO> (31)
2540123

>  <LOCATION_CODE> (31)
PTNCS

>  <AMOUNT_CURRENT> (31)
32.4

$$$$
WAY-382624-A
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 12  1  0  0  0  0
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 13  9  1  0  0  0  0
 14  5  1  0  0  0  0
 15  5  1  0  0  0  0
 16 11  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  1  0  0  0  0
 19 16  1  0  0  0  0
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  8 17  1  0  0  0  0
 13 11  2  0  0  0  0
M  END
>  <Mol_ID> (32)
32

>  <Formula> (32)
C14H16N2O2S

>  <MolWeight> (32)
276.35404

>  <PCAT_CMPD_ID> (32)
WAY-382624-A

>  <CNC_ID> (32)
359360785

>  <transfer_container_id> (32)
PTN000000069

>  <COMPOUND_NUMBER> (32)
WAY-382624-A

>  <BAR_CODE_NO> (32)
2540133

>  <LOCATION_CODE> (32)
PTNCS

>  <AMOUNT_CURRENT> (32)
32.2

$$$$
WAY-382631
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
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 14  7  1  0  0  0  0
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 16 19  1  0  0  0  0
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M  END
>  <Mol_ID> (33)
33

>  <Formula> (33)
C20H19N3O2S

>  <MolWeight> (33)
365.44876

>  <PCAT_CMPD_ID> (33)
WAY-382631

>  <CNC_ID> (33)
359360792

>  <transfer_container_id> (33)
PTN000000069

>  <COMPOUND_NUMBER> (33)
WAY-382631

>  <BAR_CODE_NO> (33)
2540140

>  <LOCATION_CODE> (33)
PTNCS

>  <AMOUNT_CURRENT> (33)
32.2

$$$$
WAY-382635
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (34)
34

>  <Formula> (34)
C17H13FN2O2S

>  <MolWeight> (34)
328.3607232

>  <PCAT_CMPD_ID> (34)
WAY-382635

>  <CNC_ID> (34)
359360796

>  <transfer_container_id> (34)
PTN000000069

>  <COMPOUND_NUMBER> (34)
WAY-382635

>  <BAR_CODE_NO> (34)
2540146

>  <LOCATION_CODE> (34)
PTNCS

>  <AMOUNT_CURRENT> (34)
32.5

$$$$
WAY-382636
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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M  END
>  <Mol_ID> (35)
35

>  <Formula> (35)
C23H20N2O4S

>  <MolWeight> (35)
420.4809

>  <PCAT_CMPD_ID> (35)
WAY-382636

>  <CNC_ID> (35)
359360797

>  <transfer_container_id> (35)
PTN000000069

>  <COMPOUND_NUMBER> (35)
WAY-382636

>  <BAR_CODE_NO> (35)
2540144

>  <LOCATION_CODE> (35)
PTNCS

>  <AMOUNT_CURRENT> (35)
32.2

$$$$
WAY-382640
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  4  1  0  0  0  0
 12 11  3  0  0  0  0
 13 10  1  0  0  0  0
 14  1  1  0  0  0  0
 15  8  2  0  0  0  0
 16  9  2  0  0  0  0
 17 10  2  0  0  0  0
 18  5  1  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21  7  1  0  0  0  0
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 25  9  1  0  0  0  0
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 19 20  2  0  0  0  0
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M  END
>  <Mol_ID> (36)
36

>  <Formula> (36)
C19H14ClF3N2O2S2

>  <MolWeight> (36)
458.9048696

>  <PCAT_CMPD_ID> (36)
WAY-382640

>  <CNC_ID> (36)
359360801

>  <transfer_container_id> (36)
PTN000000069

>  <COMPOUND_NUMBER> (36)
WAY-382640

>  <BAR_CODE_NO> (36)
2540151

>  <LOCATION_CODE> (36)
PTNCS

>  <AMOUNT_CURRENT> (36)
32.2

$$$$
WAY-382659
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  7  2  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
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 17 22  1  0  0  0  0
 21 20  2  0  0  0  0
M  END
>  <Mol_ID> (37)
37

>  <Formula> (37)
C18H14N2OS

>  <MolWeight> (37)
306.38156

>  <PCAT_CMPD_ID> (37)
WAY-382659

>  <CNC_ID> (37)
359360820

>  <transfer_container_id> (37)
PTN000000069

>  <COMPOUND_NUMBER> (37)
WAY-382659

>  <BAR_CODE_NO> (37)
2540170

>  <LOCATION_CODE> (37)
PTNCS

>  <AMOUNT_CURRENT> (37)
32.9

$$$$
WAY-382667
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 14 17  1  0  0  0  0
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M  END
>  <Mol_ID> (38)
38

>  <Formula> (38)
C13H14ClN3

>  <MolWeight> (38)
247.72336

>  <PCAT_CMPD_ID> (38)
WAY-382667

>  <CNC_ID> (38)
359360828

>  <transfer_container_id> (38)
PTN000000069

>  <COMPOUND_NUMBER> (38)
WAY-382667

>  <BAR_CODE_NO> (38)
2540179

>  <LOCATION_CODE> (38)
PTNCS

>  <AMOUNT_CURRENT> (38)
32.7

$$$$
WAY-382679
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 11  7  2  0  0  0  0
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 13  8  2  0  0  0  0
 14  8  1  0  0  0  0
 15  6  1  0  0  0  0
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 18  4  2  0  0  0  0
 19  5  1  0  0  0  0
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 24 26  1  0  0  0  0
 12 10  1  0  0  0  0
M  END
>  <Mol_ID> (39)
39

>  <Formula> (39)
C21H18FN3O2S2

>  <MolWeight> (39)
427.5149232

>  <PCAT_CMPD_ID> (39)
WAY-382679

>  <CNC_ID> (39)
359360838

>  <transfer_container_id> (39)
PTN000000069

>  <COMPOUND_NUMBER> (39)
WAY-382679

>  <BAR_CODE_NO> (39)
2540188

>  <LOCATION_CODE> (39)
PTNCS

>  <AMOUNT_CURRENT> (39)
32.1

$$$$
WAY-382719
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (40)
40

>  <Formula> (40)
C19H14N2O3S2

>  <MolWeight> (40)
382.45606

>  <PCAT_CMPD_ID> (40)
WAY-382719

>  <CNC_ID> (40)
359360878

>  <transfer_container_id> (40)
PTN000000069

>  <COMPOUND_NUMBER> (40)
WAY-382719

>  <BAR_CODE_NO> (40)
2540246

>  <LOCATION_CODE> (40)
PTNCS

>  <AMOUNT_CURRENT> (40)
32.5

$$$$
WAY-382723
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  6  2  0  0  0  0
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 14  9  1  0  0  0  0
 15  8  2  0  0  0  0
 16  8  1  0  0  0  0
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 29 25  2  0  0  0  0
 30 26  2  0  0  0  0
M  END
>  <Mol_ID> (41)
41

>  <Formula> (41)
C25H21N3O2

>  <MolWeight> (41)
395.45314

>  <PCAT_CMPD_ID> (41)
WAY-382723

>  <CNC_ID> (41)
359360882

>  <transfer_container_id> (41)
PTN000000069

>  <COMPOUND_NUMBER> (41)
WAY-382723

>  <BAR_CODE_NO> (41)
2540225

>  <LOCATION_CODE> (41)
PTNCS

>  <AMOUNT_CURRENT> (41)
32.7

$$$$
WAY-112784
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  9  2  0  0  0  0
 14  8  2  0  0  0  0
 15 14  1  0  0  0  0
 16  9  1  0  0  0  0
 17 14  1  0  0  0  0
 18 11  2  0  0  0  0
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 22 24  2  0  0  0  0
 15 12  2  0  0  0  0
M  END
>  <Mol_ID> (42)
42

>  <Formula> (42)
C18H17BrN2O3

>  <MolWeight> (42)
389.24318

>  <PCAT_CMPD_ID> (42)
WAY-112784

>  <CNC_ID> (42)
359367564

>  <transfer_container_id> (42)
PTN000000070

>  <COMPOUND_NUMBER> (42)
WAY-112784

>  <BAR_CODE_NO> (42)
3903676

>  <LOCATION_CODE> (42)
PTNCS

>  <AMOUNT_CURRENT> (42)
33.3

$$$$
WAY-113487
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
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 12  4  1  0  0  0  0
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 15  2  1  0  0  0  0
 16  2  1  0  0  0  0
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M  END
>  <Mol_ID> (43)
43

>  <Formula> (43)
C20H24N2O4S

>  <MolWeight> (43)
388.48056

>  <PCAT_CMPD_ID> (43)
WAY-113487

>  <CNC_ID> (43)
359367573

>  <transfer_container_id> (43)
PTN000000070

>  <COMPOUND_NUMBER> (43)
WAY-113487

>  <BAR_CODE_NO> (43)
3902015

>  <LOCATION_CODE> (43)
PTNCS

>  <AMOUNT_CURRENT> (43)
30.1

$$$$
WAY-114024
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 16 22  2  0  0  0  0
 19 12  1  0  0  0  0
M  END
>  <Mol_ID> (44)
44

>  <Formula> (44)
C17H14N2O3

>  <MolWeight> (44)
294.30466

>  <PCAT_CMPD_ID> (44)
WAY-114024

>  <CNC_ID> (44)
359367576

>  <transfer_container_id> (44)
PTN000000070

>  <COMPOUND_NUMBER> (44)
WAY-114024

>  <BAR_CODE_NO> (44)
3902168

>  <LOCATION_CODE> (44)
PTNCS

>  <AMOUNT_CURRENT> (44)
33.5

$$$$
WAY-114863
csChFnd80/10111816222D

 14 14  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (45)
45

>  <Formula> (45)
C10H16N2OS

>  <MolWeight> (45)
212.31184

>  <PCAT_CMPD_ID> (45)
WAY-114863

>  <CNC_ID> (45)
359367589

>  <transfer_container_id> (45)
PTN000000070

>  <COMPOUND_NUMBER> (45)
WAY-114863

>  <BAR_CODE_NO> (45)
3902853

>  <LOCATION_CODE> (45)
PTNCS

>  <AMOUNT_CURRENT> (45)
33.1

$$$$
WAY-114953
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (46)
46

>  <Formula> (46)
C16H20N2O3

>  <MolWeight> (46)
288.3416

>  <PCAT_CMPD_ID> (46)
WAY-114953

>  <CNC_ID> (46)
359367592

>  <transfer_container_id> (46)
PTN000000070

>  <COMPOUND_NUMBER> (46)
WAY-114953

>  <BAR_CODE_NO> (46)
3902476

>  <LOCATION_CODE> (46)
PTNCS

>  <AMOUNT_CURRENT> (46)
33.4

$$$$
WAY-114957
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11 10  1  0  0  0  0
 12  1  1  0  0  0  0
 13 16  1  0  0  0  0
 14  3  1  0  0  0  0
 15  8  2  0  0  0  0
 16 12  2  0  0  0  0
 17 14  1  0  0  0  0
 18 14  2  0  0  0  0
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 22  5  1  0  0  0  0
 23 19  1  0  0  0  0
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 13  4  2  0  0  0  0
 11  3  1  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (47)
47

>  <Formula> (47)
C19H17NO4

>  <MolWeight> (47)
323.34258

>  <PCAT_CMPD_ID> (47)
WAY-114957

>  <CNC_ID> (47)
359367593

>  <transfer_container_id> (47)
PTN000000070

>  <COMPOUND_NUMBER> (47)
WAY-114957

>  <BAR_CODE_NO> (47)
3904035

>  <LOCATION_CODE> (47)
PTNCS

>  <AMOUNT_CURRENT> (47)
33

$$$$
WAY-114961
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
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 22 23  1  0  0  0  0
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (48)
48

>  <Formula> (48)
C17H21ClN2O3

>  <MolWeight> (48)
336.81324

>  <PCAT_CMPD_ID> (48)
WAY-114961

>  <CNC_ID> (48)
359367594

>  <transfer_container_id> (48)
PTN000000070

>  <COMPOUND_NUMBER> (48)
WAY-114961

>  <BAR_CODE_NO> (48)
3902474

>  <LOCATION_CODE> (48)
PTNCS

>  <AMOUNT_CURRENT> (48)
33.4

$$$$
WAY-115372-A
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (49)
49

>  <Formula> (49)
C20H22N2O4

>  <MolWeight> (49)
354.39968

>  <PCAT_CMPD_ID> (49)
WAY-115372-A

>  <CNC_ID> (49)
359367602

>  <transfer_container_id> (49)
PTN000000070

>  <COMPOUND_NUMBER> (49)
WAY-115372-A

>  <BAR_CODE_NO> (49)
3902918

>  <LOCATION_CODE> (49)
PTNCS

>  <AMOUNT_CURRENT> (49)
33.4

$$$$
WAY-117083
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (50)
50

>  <Formula> (50)
C12H11N3O2

>  <MolWeight> (50)
229.23464

>  <PCAT_CMPD_ID> (50)
WAY-117083

>  <CNC_ID> (50)
359367618

>  <transfer_container_id> (50)
PTN000000070

>  <COMPOUND_NUMBER> (50)
WAY-117083

>  <BAR_CODE_NO> (50)
3902647

>  <LOCATION_CODE> (50)
PTNCS

>  <AMOUNT_CURRENT> (50)
33.2

$$$$
WAY-118225
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  2  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
 14  6  1  0  0  0  0
 15 12  2  0  0  0  0
 16 13  1  0  0  0  0
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 18  7  1  0  0  0  0
 19  8  1  0  0  0  0
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 17 15  1  0  0  0  0
M  END
>  <Mol_ID> (51)
51

>  <Formula> (51)
C18H17NO3

>  <MolWeight> (51)
295.33248

>  <PCAT_CMPD_ID> (51)
WAY-118225

>  <CNC_ID> (51)
359367635

>  <transfer_container_id> (51)
PTN000000070

>  <COMPOUND_NUMBER> (51)
WAY-118225

>  <BAR_CODE_NO> (51)
3902246

>  <LOCATION_CODE> (51)
PTNCS

>  <AMOUNT_CURRENT> (51)
33.2

$$$$
WAY-119064
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (52)
52

>  <Formula> (52)
C13H18N2O3S

>  <MolWeight> (52)
282.35862

>  <PCAT_CMPD_ID> (52)
WAY-119064

>  <CNC_ID> (52)
359367654

>  <transfer_container_id> (52)
PTN000000070

>  <COMPOUND_NUMBER> (52)
WAY-119064

>  <BAR_CODE_NO> (52)
3904052

>  <LOCATION_CODE> (52)
PTNCS

>  <AMOUNT_CURRENT> (52)
33.2

$$$$
WAY-119075
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (53)
53

>  <Formula> (53)
C20H28N2O2

>  <MolWeight> (53)
328.44852

>  <PCAT_CMPD_ID> (53)
WAY-119075

>  <CNC_ID> (53)
359367655

>  <transfer_container_id> (53)
PTN000000070

>  <COMPOUND_NUMBER> (53)
WAY-119075

>  <BAR_CODE_NO> (53)
3901943

>  <LOCATION_CODE> (53)
PTNCS

>  <AMOUNT_CURRENT> (53)
33.1

$$$$
WAY-119132
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (54)
54

>  <Formula> (54)
C13H14N2O2S

>  <MolWeight> (54)
262.32746

>  <PCAT_CMPD_ID> (54)
WAY-119132

>  <CNC_ID> (54)
359367657

>  <transfer_container_id> (54)
PTN000000070

>  <COMPOUND_NUMBER> (54)
WAY-119132

>  <BAR_CODE_NO> (54)
3901817

>  <LOCATION_CODE> (54)
PTNCS

>  <AMOUNT_CURRENT> (54)
33.3

$$$$
WAY-119174
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (55)
55

>  <Formula> (55)
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>  <MolWeight> (55)
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>  <PCAT_CMPD_ID> (55)
WAY-119174

>  <CNC_ID> (55)
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>  <transfer_container_id> (55)
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>  <COMPOUND_NUMBER> (55)
WAY-119174

>  <BAR_CODE_NO> (55)
3902292

>  <LOCATION_CODE> (55)
PTNCS

>  <AMOUNT_CURRENT> (55)
33.1

$$$$
WAY-119573
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (56)
56

>  <Formula> (56)
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>  <MolWeight> (56)
259.30038

>  <PCAT_CMPD_ID> (56)
WAY-119573

>  <CNC_ID> (56)
359367665

>  <transfer_container_id> (56)
PTN000000070

>  <COMPOUND_NUMBER> (56)
WAY-119573

>  <BAR_CODE_NO> (56)
3904130

>  <LOCATION_CODE> (56)
PTNCS

>  <AMOUNT_CURRENT> (56)
33.3

$$$$
WAY-119910
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (57)
57

>  <Formula> (57)
C21H26FN3O3

>  <MolWeight> (57)
387.4478432

>  <PCAT_CMPD_ID> (57)
WAY-119910

>  <CNC_ID> (57)
359367671

>  <transfer_container_id> (57)
PTN000000070

>  <COMPOUND_NUMBER> (57)
WAY-119910

>  <BAR_CODE_NO> (57)
3903609

>  <LOCATION_CODE> (57)
PTNCS

>  <AMOUNT_CURRENT> (57)
33.5

$$$$
WAY-119954
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (58)
58

>  <Formula> (58)
C13H17ClN2O

>  <MolWeight> (58)
252.73988

>  <PCAT_CMPD_ID> (58)
WAY-119954

>  <CNC_ID> (58)
359367672

>  <transfer_container_id> (58)
PTN000000070

>  <COMPOUND_NUMBER> (58)
WAY-119954

>  <BAR_CODE_NO> (58)
3901754

>  <LOCATION_CODE> (58)
PTNCS

>  <AMOUNT_CURRENT> (58)
33.3

$$$$
WAY-119960-A
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (59)
59

>  <Formula> (59)
C16H24N2O2

>  <MolWeight> (59)
276.37396

>  <PCAT_CMPD_ID> (59)
WAY-119960-A

>  <CNC_ID> (59)
359367673

>  <transfer_container_id> (59)
PTN000000070

>  <COMPOUND_NUMBER> (59)
WAY-119960-A

>  <BAR_CODE_NO> (59)
3903918

>  <LOCATION_CODE> (59)
PTNCS

>  <AMOUNT_CURRENT> (59)
33.1

$$$$
WAY-119975
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (60)
60

>  <Formula> (60)
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>  <MolWeight> (60)
367.4597432

>  <PCAT_CMPD_ID> (60)
WAY-119975

>  <CNC_ID> (60)
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>  <transfer_container_id> (60)
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>  <COMPOUND_NUMBER> (60)
WAY-119975

>  <BAR_CODE_NO> (60)
3903624

>  <LOCATION_CODE> (60)
PTNCS

>  <AMOUNT_CURRENT> (60)
33.1

$$$$
WAY-119983-A
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (61)
61

>  <Formula> (61)
C22H26FN3O

>  <MolWeight> (61)
367.4597432

>  <PCAT_CMPD_ID> (61)
WAY-119983-A

>  <CNC_ID> (61)
359367677

>  <transfer_container_id> (61)
PTN000000070

>  <COMPOUND_NUMBER> (61)
WAY-119983-A

>  <BAR_CODE_NO> (61)
3903986

>  <LOCATION_CODE> (61)
PTNCS

>  <AMOUNT_CURRENT> (61)
33.3

$$$$
WAY-119998
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (62)
62

>  <Formula> (62)
C15H22N2O

>  <MolWeight> (62)
246.34798

>  <PCAT_CMPD_ID> (62)
WAY-119998

>  <CNC_ID> (62)
359367679

>  <transfer_container_id> (62)
PTN000000070

>  <COMPOUND_NUMBER> (62)
WAY-119998

>  <BAR_CODE_NO> (62)
3901704

>  <LOCATION_CODE> (62)
PTNCS

>  <AMOUNT_CURRENT> (62)
33.1

$$$$
WAY-194754
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (63)
63

>  <Formula> (63)
C12H17N3O2

>  <MolWeight> (63)
235.28228

>  <PCAT_CMPD_ID> (63)
WAY-194754

>  <CNC_ID> (63)
359367683

>  <transfer_container_id> (63)
PTN000000070

>  <COMPOUND_NUMBER> (63)
WAY-194754

>  <BAR_CODE_NO> (63)
3902303

>  <LOCATION_CODE> (63)
PTNCS

>  <AMOUNT_CURRENT> (63)
33.1

$$$$
WAY-215245
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (64)
64

>  <Formula> (64)
C22H30N2O2

>  <MolWeight> (64)
354.4858

>  <PCAT_CMPD_ID> (64)
WAY-215245

>  <CNC_ID> (64)
359367686

>  <transfer_container_id> (64)
PTN000000070

>  <COMPOUND_NUMBER> (64)
WAY-215245

>  <BAR_CODE_NO> (64)
3903759

>  <LOCATION_CODE> (64)
PTNCS

>  <AMOUNT_CURRENT> (64)
33.3

$$$$
WAY-215718
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (65)
65

>  <Formula> (65)
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>  <MolWeight> (65)
229.32076

>  <PCAT_CMPD_ID> (65)
WAY-215718

>  <CNC_ID> (65)
359367687

>  <transfer_container_id> (65)
PTN000000070

>  <COMPOUND_NUMBER> (65)
WAY-215718

>  <BAR_CODE_NO> (65)
3901739

>  <LOCATION_CODE> (65)
PTNCS

>  <AMOUNT_CURRENT> (65)
33.3

$$$$
WAY-215857
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (66)
66

>  <Formula> (66)
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>  <MolWeight> (66)
212.24718

>  <PCAT_CMPD_ID> (66)
WAY-215857

>  <CNC_ID> (66)
359367689

>  <transfer_container_id> (66)
PTN000000070

>  <COMPOUND_NUMBER> (66)
WAY-215857

>  <BAR_CODE_NO> (66)
3903740

>  <LOCATION_CODE> (66)
PTNCS

>  <AMOUNT_CURRENT> (66)
33.3

$$$$
WAY-217211-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11  5  2  0  0  0  0
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 21  9  1  0  0  0  0
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 13 12  2  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (67)
67

>  <Formula> (67)
C15H13N3OS2

>  <MolWeight> (67)
315.41322

>  <PCAT_CMPD_ID> (67)
WAY-217211-A

>  <CNC_ID> (67)
359367702

>  <transfer_container_id> (67)
PTN000000070

>  <COMPOUND_NUMBER> (67)
WAY-217211-A

>  <BAR_CODE_NO> (67)
3903820

>  <LOCATION_CODE> (67)
PTNCS

>  <AMOUNT_CURRENT> (67)
33.5

$$$$
WAY-217570
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
 12  2  1  0  0  0  0
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 15  6  1  0  0  0  0
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 19 15  2  0  0  0  0
M  END
>  <Mol_ID> (68)
68

>  <Formula> (68)
C16H25NO2

>  <MolWeight> (68)
263.3752

>  <PCAT_CMPD_ID> (68)
WAY-217570

>  <CNC_ID> (68)
359367706

>  <transfer_container_id> (68)
PTN000000070

>  <COMPOUND_NUMBER> (68)
WAY-217570

>  <BAR_CODE_NO> (68)
3902214

>  <LOCATION_CODE> (68)
PTNCS

>  <AMOUNT_CURRENT> (68)
33.3

$$$$
WAY-217773
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.9869    1.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
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M  END
>  <Mol_ID> (69)
69

>  <Formula> (69)
C15H12FNO3S

>  <MolWeight> (69)
305.3240832

>  <PCAT_CMPD_ID> (69)
WAY-217773

>  <CNC_ID> (69)
359367708

>  <transfer_container_id> (69)
PTN000000070

>  <COMPOUND_NUMBER> (69)
WAY-217773

>  <BAR_CODE_NO> (69)
3901502

>  <LOCATION_CODE> (69)
PTNCS

>  <AMOUNT_CURRENT> (69)
33.5

$$$$
WAY-219134
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (70)
70

>  <Formula> (70)
C15H10ClNO2

>  <MolWeight> (70)
271.6984

>  <PCAT_CMPD_ID> (70)
WAY-219134

>  <CNC_ID> (70)
359367716

>  <transfer_container_id> (70)
PTN000000070

>  <COMPOUND_NUMBER> (70)
WAY-219134

>  <BAR_CODE_NO> (70)
3903005

>  <LOCATION_CODE> (70)
PTNCS

>  <AMOUNT_CURRENT> (70)
30.3

$$$$
WAY-222208
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 14  2  1  0  0  0  0
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M  END
>  <Mol_ID> (71)
71

>  <Formula> (71)
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>  <MolWeight> (71)
295.33248

>  <PCAT_CMPD_ID> (71)
WAY-222208

>  <CNC_ID> (71)
359367723

>  <transfer_container_id> (71)
PTN000000070

>  <COMPOUND_NUMBER> (71)
WAY-222208

>  <BAR_CODE_NO> (71)
3903473

>  <LOCATION_CODE> (71)
PTNCS

>  <AMOUNT_CURRENT> (71)
33.5

$$$$
WAY-224404
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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    1.0462    1.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4290    1.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0462    2.3556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4290    2.3556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0255    3.9728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
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 15 18  1  0  0  0  0
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 18 20  2  0  0  0  0
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 23 24  1  0  0  0  0
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  7  9  1  0  0  0  0
 12 13  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (72)
72

>  <Formula> (72)
C17H16N2O5S

>  <MolWeight> (72)
360.38434

>  <PCAT_CMPD_ID> (72)
WAY-224404

>  <CNC_ID> (72)
359367733

>  <transfer_container_id> (72)
PTN000000070

>  <COMPOUND_NUMBER> (72)
WAY-224404

>  <BAR_CODE_NO> (72)
3902425

>  <LOCATION_CODE> (72)
PTNCS

>  <AMOUNT_CURRENT> (72)
33

$$$$
WAY-224513
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    0.0618   -0.5476    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  3  9  2  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  7 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  2  0  0  0  0
 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  5 10  1  0  0  0  0
 12 15  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (73)
73

>  <Formula> (73)
C13H11N3O3S

>  <MolWeight> (73)
289.30974

>  <PCAT_CMPD_ID> (73)
WAY-224513

>  <CNC_ID> (73)
359367735

>  <transfer_container_id> (73)
PTN000000070

>  <COMPOUND_NUMBER> (73)
WAY-224513

>  <BAR_CODE_NO> (73)
3902638

>  <LOCATION_CODE> (73)
PTNCS

>  <AMOUNT_CURRENT> (73)
33.5

$$$$
WAY-226614
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    3.0988    7.2241    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2668    5.8923    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8255    4.5604    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.4892    6.9868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7  3  1  0  0  0  0
  8  3  1  0  0  0  0
  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11  4  2  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14  9  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  2  0  0  0  0
 17 12  1  0  0  0  0
 18 13  2  0  0  0  0
 19 11  1  0  0  0  0
 20 10  2  0  0  0  0
 21 16  1  0  0  0  0
 22 15  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
 16 20  1  0  0  0  0
 14  7  1  0  0  0  0
 15 17  2  0  0  0  0
M  END
>  <Mol_ID> (74)
74

>  <Formula> (74)
C17H19NO4S2

>  <MolWeight> (74)
365.46706

>  <PCAT_CMPD_ID> (74)
WAY-226614

>  <CNC_ID> (74)
359367744

>  <transfer_container_id> (74)
PTN000000070

>  <COMPOUND_NUMBER> (74)
WAY-226614

>  <BAR_CODE_NO> (74)
3901747

>  <LOCATION_CODE> (74)
PTNCS

>  <AMOUNT_CURRENT> (74)
33.2

$$$$
WAY-226893
csChFnd80/10111816222D

 27 31  0  0  0  0  0  0  0  0999 V2000
    6.3138    3.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8972    3.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0387    2.4348    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    4.2204    2.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0000    4.8381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8370    2.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6079    3.6466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3494    2.4791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11 10  2  0  0  0  0
 12  9  2  0  0  0  0
 13  6  1  0  0  0  0
 14 18  2  0  0  0  0
 15 12  1  0  0  0  0
 16  7  2  0  0  0  0
 17  8  2  0  0  0  0
 18 16  1  0  0  0  0
 19 13  2  0  0  0  0
 20  2  1  0  0  0  0
 21 11  1  0  0  0  0
 22 14  1  0  0  0  0
 23  8  1  0  0  0  0
 24 23  1  0  0  0  0
 25  9  1  0  0  0  0
 26 27  1  0  0  0  0
 27 25  2  0  0  0  0
 20 24  1  0  0  0  0
  6  5  2  0  0  0  0
 11 14  1  0  0  0  0
 12 19  1  0  0  0  0
 26 15  2  0  0  0  0
M  END
>  <Mol_ID> (75)
75

>  <Formula> (75)
C22H18N2O3

>  <MolWeight> (75)
358.38992

>  <PCAT_CMPD_ID> (75)
WAY-226893

>  <CNC_ID> (75)
359367752

>  <transfer_container_id> (75)
PTN000000070

>  <COMPOUND_NUMBER> (75)
WAY-226893

>  <BAR_CODE_NO> (75)
3902469

>  <LOCATION_CODE> (75)
PTNCS

>  <AMOUNT_CURRENT> (75)
33.4

$$$$
WAY-227269
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    2.4827    4.7328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  2  0  0  0  0
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  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
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  8  1  1  0  0  0  0
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 10  4  2  0  0  0  0
 11  6  1  0  0  0  0
 12  3  1  0  0  0  0
 13  8  2  0  0  0  0
 14  7  1  0  0  0  0
 15 22  1  0  0  0  0
 16 11  1  0  0  0  0
 17  6  2  0  0  0  0
 18  9  1  0  0  0  0
 19  9  1  0  0  0  0
 20  8  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
 23 11  2  0  0  0  0
 24 16  1  0  0  0  0
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 26 25  2  0  0  0  0
  2  4  1  0  0  0  0
 23 26  1  0  0  0  0
 21 15  1  0  0  0  0
M  END
>  <Mol_ID> (76)
76

>  <Formula> (76)
C19H24N2O5

>  <MolWeight> (76)
360.40426

>  <PCAT_CMPD_ID> (76)
WAY-227269

>  <CNC_ID> (76)
359367755

>  <transfer_container_id> (76)
PTN000000070

>  <COMPOUND_NUMBER> (76)
WAY-227269

>  <BAR_CODE_NO> (76)
3901916

>  <LOCATION_CODE> (76)
PTNCS

>  <AMOUNT_CURRENT> (76)
33.5

$$$$
WAY-227616
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    3.2379    2.4974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  2  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13  8  2  0  0  0  0
 14  8  1  0  0  0  0
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 17 22  1  0  0  0  0
 18  9  1  0  0  0  0
M  END
>  <Mol_ID> (77)
77

>  <Formula> (77)
C17H17NO4

>  <MolWeight> (77)
299.32118

>  <PCAT_CMPD_ID> (77)
WAY-227616

>  <CNC_ID> (77)
359367757

>  <transfer_container_id> (77)
PTN000000070

>  <COMPOUND_NUMBER> (77)
WAY-227616

>  <BAR_CODE_NO> (77)
3902147

>  <LOCATION_CODE> (77)
PTNCS

>  <AMOUNT_CURRENT> (77)
33.2

$$$$
WAY-227649
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11 14  1  0  0  0  0
 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15  4  2  0  0  0  0
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 18  9  2  0  0  0  0
 19 14  1  0  0  0  0
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 22 18  1  0  0  0  0
 17 21  1  0  0  0  0
M  END
>  <Mol_ID> (78)
78

>  <Formula> (78)
C16H17ClN2O3

>  <MolWeight> (78)
320.77078

>  <PCAT_CMPD_ID> (78)
WAY-227649

>  <CNC_ID> (78)
359367758

>  <transfer_container_id> (78)
PTN000000070

>  <COMPOUND_NUMBER> (78)
WAY-227649

>  <BAR_CODE_NO> (78)
3904099

>  <LOCATION_CODE> (78)
PTNCS

>  <AMOUNT_CURRENT> (78)
33.3

$$$$
WAY-229016
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
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 19 20  1  0  0  0  0
 13  9  2  0  0  0  0
M  END
>  <Mol_ID> (79)
79

>  <Formula> (79)
C16H13N3O

>  <MolWeight> (79)
263.29392

>  <PCAT_CMPD_ID> (79)
WAY-229016

>  <CNC_ID> (79)
359367763

>  <transfer_container_id> (79)
PTN000000070

>  <COMPOUND_NUMBER> (79)
WAY-229016

>  <BAR_CODE_NO> (79)
3902217

>  <LOCATION_CODE> (79)
PTNCS

>  <AMOUNT_CURRENT> (79)
33.5

$$$$
WAY-229584
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -2.0653   -0.7034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (80)
80

>  <Formula> (80)
C18H19FN2O

>  <MolWeight> (80)
298.3546632

>  <PCAT_CMPD_ID> (80)
WAY-229584

>  <CNC_ID> (80)
359367767

>  <transfer_container_id> (80)
PTN000000070

>  <COMPOUND_NUMBER> (80)
WAY-229584

>  <BAR_CODE_NO> (80)
3901682

>  <LOCATION_CODE> (80)
PTNCS

>  <AMOUNT_CURRENT> (80)
33.1

$$$$
WAY-229944
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 18  7  1  0  0  0  0
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M  END
>  <Mol_ID> (81)
81

>  <Formula> (81)
C14H8ClN3O3

>  <MolWeight> (81)
301.68462

>  <PCAT_CMPD_ID> (81)
WAY-229944

>  <CNC_ID> (81)
359367772

>  <transfer_container_id> (81)
PTN000000070

>  <COMPOUND_NUMBER> (81)
WAY-229944

>  <BAR_CODE_NO> (81)
3902091

>  <LOCATION_CODE> (81)
PTNCS

>  <AMOUNT_CURRENT> (81)
33.3

$$$$
WAY-230580
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (82)
82

>  <Formula> (82)
C17H17N3O3S

>  <MolWeight> (82)
343.40018

>  <PCAT_CMPD_ID> (82)
WAY-230580

>  <CNC_ID> (82)
359367773

>  <transfer_container_id> (82)
PTN000000070

>  <COMPOUND_NUMBER> (82)
WAY-230580

>  <BAR_CODE_NO> (82)
3903677

>  <LOCATION_CODE> (82)
PTNCS

>  <AMOUNT_CURRENT> (82)
33.5

$$$$
WAY-230678
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  5  1  0  0  0  0
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M  END
>  <Mol_ID> (83)
83

>  <Formula> (83)
C16H12N2O

>  <MolWeight> (83)
248.27928

>  <PCAT_CMPD_ID> (83)
WAY-230678

>  <CNC_ID> (83)
359367774

>  <transfer_container_id> (83)
PTN000000070

>  <COMPOUND_NUMBER> (83)
WAY-230678

>  <BAR_CODE_NO> (83)
3901614

>  <LOCATION_CODE> (83)
PTNCS

>  <AMOUNT_CURRENT> (83)
33.5

$$$$
WAY-231039
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    1.7761   -1.3205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (84)
84

>  <Formula> (84)
C13H16BrNO2

>  <MolWeight> (84)
298.17564

>  <PCAT_CMPD_ID> (84)
WAY-231039

>  <CNC_ID> (84)
359367778

>  <transfer_container_id> (84)
PTN000000070

>  <COMPOUND_NUMBER> (84)
WAY-231039

>  <BAR_CODE_NO> (84)
3901489

>  <LOCATION_CODE> (84)
PTNCS

>  <AMOUNT_CURRENT> (84)
33.1

$$$$
WAY-231490
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (85)
85

>  <Formula> (85)
C13H12ClNO3

>  <MolWeight> (85)
265.69228

>  <PCAT_CMPD_ID> (85)
WAY-231490

>  <CNC_ID> (85)
359367785

>  <transfer_container_id> (85)
PTN000000070

>  <COMPOUND_NUMBER> (85)
WAY-231490

>  <BAR_CODE_NO> (85)
3901902

>  <LOCATION_CODE> (85)
PTNCS

>  <AMOUNT_CURRENT> (85)
33.1

$$$$
WAY-232669
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (86)
86

>  <Formula> (86)
C15H14N2O4

>  <MolWeight> (86)
286.28266

>  <PCAT_CMPD_ID> (86)
WAY-232669

>  <CNC_ID> (86)
359367804

>  <transfer_container_id> (86)
PTN000000070

>  <COMPOUND_NUMBER> (86)
WAY-232669

>  <BAR_CODE_NO> (86)
3902566

>  <LOCATION_CODE> (86)
PTNCS

>  <AMOUNT_CURRENT> (86)
33.4

$$$$
WAY-232899
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (87)
87

>  <Formula> (87)
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>  <MolWeight> (87)
391.44628

>  <PCAT_CMPD_ID> (87)
WAY-232899

>  <CNC_ID> (87)
359367807

>  <transfer_container_id> (87)
PTN000000070

>  <COMPOUND_NUMBER> (87)
WAY-232899

>  <BAR_CODE_NO> (87)
3902830

>  <LOCATION_CODE> (87)
PTNCS

>  <AMOUNT_CURRENT> (87)
33.2

$$$$
WAY-233812
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 17 23  1  0  0  0  0
 18 24  2  0  0  0  0
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 16 22  1  0  0  0  0
 17 19  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (88)
88

>  <Formula> (88)
C20H13N5

>  <MolWeight> (88)
323.35072

>  <PCAT_CMPD_ID> (88)
WAY-233812

>  <CNC_ID> (88)
359367822

>  <transfer_container_id> (88)
PTN000000070

>  <COMPOUND_NUMBER> (88)
WAY-233812

>  <BAR_CODE_NO> (88)
3903581

>  <LOCATION_CODE> (88)
PTNCS

>  <AMOUNT_CURRENT> (88)
33.1

$$$$
WAY-234610-B
csChFnd80/10111816222D

 15 17  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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 12 14  2  0  0  0  0
M  END
>  <Mol_ID> (89)
89

>  <Formula> (89)
C12H15N3

>  <MolWeight> (89)
201.2676

>  <PCAT_CMPD_ID> (89)
WAY-234610-B

>  <CNC_ID> (89)
359367831

>  <transfer_container_id> (89)
PTN000000070

>  <COMPOUND_NUMBER> (89)
WAY-234610-B

>  <BAR_CODE_NO> (89)
3901766

>  <LOCATION_CODE> (89)
PTNCS

>  <AMOUNT_CURRENT> (89)
33.1

$$$$
WAY-234992
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    4.5555    2.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  2  0  0  0  0
 11 13  2  0  0  0  0
 12  7  2  0  0  0  0
 13 12  1  0  0  0  0
 14  3  1  0  0  0  0
 15 10  1  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18  5  1  0  0  0  0
 19  6  1  0  0  0  0
 20 15  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23 19  2  0  0  0  0
  5  6  2  0  0  0  0
 22 23  1  0  0  0  0
 10 11  1  0  0  0  0
M  END
>  <Mol_ID> (90)
90

>  <Formula> (90)
C18H20N2O3

>  <MolWeight> (90)
312.363

>  <PCAT_CMPD_ID> (90)
WAY-234992

>  <CNC_ID> (90)
359367837

>  <transfer_container_id> (90)
PTN000000070

>  <COMPOUND_NUMBER> (90)
WAY-234992

>  <BAR_CODE_NO> (90)
3901524

>  <LOCATION_CODE> (90)
PTNCS

>  <AMOUNT_CURRENT> (90)
33.2

$$$$
WAY-235924
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    8.7695    0.3090    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  1  0  0  0  0
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 12  9  2  0  0  0  0
 13  9  1  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
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 18 17  1  0  0  0  0
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  5  2  2  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <Mol_ID> (91)
91

>  <Formula> (91)
C13H13N3O2S

>  <MolWeight> (91)
275.32622

>  <PCAT_CMPD_ID> (91)
WAY-235924

>  <CNC_ID> (91)
359367845

>  <transfer_container_id> (91)
PTN000000070

>  <COMPOUND_NUMBER> (91)
WAY-235924

>  <BAR_CODE_NO> (91)
3903508

>  <LOCATION_CODE> (91)
PTNCS

>  <AMOUNT_CURRENT> (91)
33.5

$$$$
WAY-236469
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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  5  1  2  0  0  0  0
  6  5  1  0  0  0  0
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 10  6  2  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13  8  2  0  0  0  0
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  3  4  1  0  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (92)
92

>  <Formula> (92)
C11H11N3O3

>  <MolWeight> (92)
233.22334

>  <PCAT_CMPD_ID> (92)
WAY-236469

>  <CNC_ID> (92)
359367858

>  <transfer_container_id> (92)
PTN000000070

>  <COMPOUND_NUMBER> (92)
WAY-236469

>  <BAR_CODE_NO> (92)
3902654

>  <LOCATION_CODE> (92)
PTNCS

>  <AMOUNT_CURRENT> (92)
33.3

$$$$
WAY-299654
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
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 14 16  1  0  0  0  0
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M  END
>  <Mol_ID> (93)
93

>  <Formula> (93)
C17H13NO5

>  <MolWeight> (93)
311.28882

>  <PCAT_CMPD_ID> (93)
WAY-299654

>  <CNC_ID> (93)
359370331

>  <transfer_container_id> (93)
PTN000000070

>  <COMPOUND_NUMBER> (93)
WAY-299654

>  <BAR_CODE_NO> (93)
3901499

>  <LOCATION_CODE> (93)
PTNCS

>  <AMOUNT_CURRENT> (93)
33.2

$$$$
WAY-299656
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (94)
94

>  <Formula> (94)
C18H15NO3S

>  <MolWeight> (94)
325.3816

>  <PCAT_CMPD_ID> (94)
WAY-299656

>  <CNC_ID> (94)
359370333

>  <transfer_container_id> (94)
PTN000000070

>  <COMPOUND_NUMBER> (94)
WAY-299656

>  <BAR_CODE_NO> (94)
3901503

>  <LOCATION_CODE> (94)
PTNCS

>  <AMOUNT_CURRENT> (94)
33.1

$$$$
WAY-299660
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
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 15  5  2  0  0  0  0
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M  END
>  <Mol_ID> (95)
95

>  <Formula> (95)
C22H17N3O3S

>  <MolWeight> (95)
403.45368

>  <PCAT_CMPD_ID> (95)
WAY-299660

>  <CNC_ID> (95)
359370337

>  <transfer_container_id> (95)
PTN000000070

>  <COMPOUND_NUMBER> (95)
WAY-299660

>  <BAR_CODE_NO> (95)
3901507

>  <LOCATION_CODE> (95)
PTNCS

>  <AMOUNT_CURRENT> (95)
33.2

$$$$
WAY-299674
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (96)
96

>  <Formula> (96)
C17H14O3S

>  <MolWeight> (96)
298.35626

>  <PCAT_CMPD_ID> (96)
WAY-299674

>  <CNC_ID> (96)
359370351

>  <transfer_container_id> (96)
PTN000000070

>  <COMPOUND_NUMBER> (96)
WAY-299674

>  <BAR_CODE_NO> (96)
3901521

>  <LOCATION_CODE> (96)
PTNCS

>  <AMOUNT_CURRENT> (96)
33.5

$$$$
WAY-299693
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (97)
97

>  <Formula> (97)
C11H14N2O3S

>  <MolWeight> (97)
254.30546

>  <PCAT_CMPD_ID> (97)
WAY-299693

>  <CNC_ID> (97)
359370370

>  <transfer_container_id> (97)
PTN000000070

>  <COMPOUND_NUMBER> (97)
WAY-299693

>  <BAR_CODE_NO> (97)
3901546

>  <LOCATION_CODE> (97)
PTNCS

>  <AMOUNT_CURRENT> (97)
33.3

$$$$
WAY-299696
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (98)
98

>  <Formula> (98)
C19H14N2OS

>  <MolWeight> (98)
318.39226

>  <PCAT_CMPD_ID> (98)
WAY-299696

>  <CNC_ID> (98)
359370373

>  <transfer_container_id> (98)
PTN000000070

>  <COMPOUND_NUMBER> (98)
WAY-299696

>  <BAR_CODE_NO> (98)
3901549

>  <LOCATION_CODE> (98)
PTNCS

>  <AMOUNT_CURRENT> (98)
33.4

$$$$
WAY-299703
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (99)
99

>  <Formula> (99)
C15H20N2O3S

>  <MolWeight> (99)
308.3959

>  <PCAT_CMPD_ID> (99)
WAY-299703

>  <CNC_ID> (99)
359370380

>  <transfer_container_id> (99)
PTN000000070

>  <COMPOUND_NUMBER> (99)
WAY-299703

>  <BAR_CODE_NO> (99)
3901556

>  <LOCATION_CODE> (99)
PTNCS

>  <AMOUNT_CURRENT> (99)
30.2

$$$$
WAY-299704
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  2  1  0  0  0  0
 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  2  0  0  0  0
 14  6  1  0  0  0  0
 15 11  1  0  0  0  0
 16 20  1  0  0  0  0
 17 16  1  0  0  0  0
 18 15  2  0  0  0  0
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 22 10  1  0  0  0  0
 23 10  1  0  0  0  0
  5  4  1  0  0  0  0
  9  8  1  0  0  0  0
 16 21  2  0  0  0  0
M  END
>  <Mol_ID> (100)
100

>  <Formula> (100)
C15H16FN5O2

>  <MolWeight> (100)
317.3182432

>  <PCAT_CMPD_ID> (100)
WAY-299704

>  <CNC_ID> (100)
359370381

>  <transfer_container_id> (100)
PTN000000070

>  <COMPOUND_NUMBER> (100)
WAY-299704

>  <BAR_CODE_NO> (100)
3901557

>  <LOCATION_CODE> (100)
PTNCS

>  <AMOUNT_CURRENT> (100)
33.4

$$$$
WAY-300006
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  1  0  0  0  0
  9 13  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (101)
101

>  <Formula> (101)
C16H17N3O2S

>  <MolWeight> (101)
315.39008

>  <PCAT_CMPD_ID> (101)
WAY-300006

>  <CNC_ID> (101)
359370684

>  <transfer_container_id> (101)
PTN000000070

>  <COMPOUND_NUMBER> (101)
WAY-300006

>  <BAR_CODE_NO> (101)
3901947

>  <LOCATION_CODE> (101)
PTNCS

>  <AMOUNT_CURRENT> (101)
33.1

$$$$
WAY-300015
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  9 11  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (102)
102

>  <Formula> (102)
C19H18N2O

>  <MolWeight> (102)
290.35902

>  <PCAT_CMPD_ID> (102)
WAY-300015

>  <CNC_ID> (102)
359370693

>  <transfer_container_id> (102)
PTN000000070

>  <COMPOUND_NUMBER> (102)
WAY-300015

>  <BAR_CODE_NO> (102)
3901957

>  <LOCATION_CODE> (102)
PTNCS

>  <AMOUNT_CURRENT> (102)
33.4

$$$$
WAY-300017
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (103)
103

>  <Formula> (103)
C18H14F3N3OS3

>  <MolWeight> (103)
441.5134696

>  <PCAT_CMPD_ID> (103)
WAY-300017

>  <CNC_ID> (103)
359370695

>  <transfer_container_id> (103)
PTN000000070

>  <COMPOUND_NUMBER> (103)
WAY-300017

>  <BAR_CODE_NO> (103)
3901960

>  <LOCATION_CODE> (103)
PTNCS

>  <AMOUNT_CURRENT> (103)
33.1

$$$$
WAY-300030
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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   -3.5896    0.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5896   -0.5237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9691   -0.5237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5482   -1.1065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9622    0.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9139   -1.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4792   -0.5237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  2  0  0  0  0
 21 25  1  0  0  0  0
  8 11  1  0  0  0  0
 13 15  2  0  0  0  0
 22 25  2  0  0  0  0
M  END
>  <Mol_ID> (104)
104

>  <Formula> (104)
C21H23NO3

>  <MolWeight> (104)
337.41222

>  <PCAT_CMPD_ID> (104)
WAY-300030

>  <CNC_ID> (104)
359370708

>  <transfer_container_id> (104)
PTN000000070

>  <COMPOUND_NUMBER> (104)
WAY-300030

>  <BAR_CODE_NO> (104)
3901982

>  <LOCATION_CODE> (104)
PTNCS

>  <AMOUNT_CURRENT> (104)
33.1

$$$$
WAY-300032
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
   -0.0034   -0.1690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0034    0.5862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6448   -0.5448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6586   -0.5448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6448    0.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6552   -1.2931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6138    0.5862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
 14 21  1  0  0  0  0
 17 22  2  0  0  0  0
 20 23  2  0  0  0  0
  9 13  2  0  0  0  0
 16 21  2  0  0  0  0
 18 19  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (105)
105

>  <Formula> (105)
C18H13N3O2

>  <MolWeight> (105)
303.31472

>  <PCAT_CMPD_ID> (105)
WAY-300032

>  <CNC_ID> (105)
359370710

>  <transfer_container_id> (105)
PTN000000070

>  <COMPOUND_NUMBER> (105)
WAY-300032

>  <BAR_CODE_NO> (105)
3901984

>  <LOCATION_CODE> (105)
PTNCS

>  <AMOUNT_CURRENT> (105)
33.4

$$$$
WAY-300037
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   -1.8435   -0.1268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0539    0.6663    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7953    0.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7435   -1.2130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6608    1.4284    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7392    0.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6772    0.6318    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (106)
106

>  <Formula> (106)
C13H11ClN4

>  <MolWeight> (106)
258.70624

>  <PCAT_CMPD_ID> (106)
WAY-300037

>  <CNC_ID> (106)
359370714

>  <transfer_container_id> (106)
PTN000000070

>  <COMPOUND_NUMBER> (106)
WAY-300037

>  <BAR_CODE_NO> (106)
3901990

>  <LOCATION_CODE> (106)
PTNCS

>  <AMOUNT_CURRENT> (106)
33.2

$$$$
WAY-300040
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    0.7655    0.4414    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5276    0.4414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3517    1.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5276   -0.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
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  7 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
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 16 18  1  0  0  0  0
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 18 20  2  0  0  0  0
  5  8  1  0  0  0  0
 14 15  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (107)
107

>  <Formula> (107)
C15H11NO2S2

>  <MolWeight> (107)
301.38334

>  <PCAT_CMPD_ID> (107)
WAY-300040

>  <CNC_ID> (107)
359370717

>  <transfer_container_id> (107)
PTN000000070

>  <COMPOUND_NUMBER> (107)
WAY-300040

>  <BAR_CODE_NO> (107)
3901994

>  <LOCATION_CODE> (107)
PTNCS

>  <AMOUNT_CURRENT> (107)
33.4

$$$$
WAY-300043
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -0.1724    0.7862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1724    1.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6000    0.7862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 15  1  0  0  0  0
 11 16  2  0  0  0  0
 12 17  2  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  2  0  0  0  0
 15 21  1  0  0  0  0
 18 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
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  9 13  2  0  0  0  0
 16 20  1  0  0  0  0
M  END
>  <Mol_ID> (108)
108

>  <Formula> (108)
C19H20O6

>  <MolWeight> (108)
344.3585

>  <PCAT_CMPD_ID> (108)
WAY-300043

>  <CNC_ID> (108)
359370720

>  <transfer_container_id> (108)
PTN000000070

>  <COMPOUND_NUMBER> (108)
WAY-300043

>  <BAR_CODE_NO> (108)
3901998

>  <LOCATION_CODE> (108)
PTNCS

>  <AMOUNT_CURRENT> (108)
33.3

$$$$
WAY-300046
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
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  7  8  2  0  0  0  0
 14 15  1  0  0  0  0
M  END
>  <Mol_ID> (109)
109

>  <Formula> (109)
C12H13N3O2

>  <MolWeight> (109)
231.25052

>  <PCAT_CMPD_ID> (109)
WAY-300046

>  <CNC_ID> (109)
359370723

>  <transfer_container_id> (109)
PTN000000070

>  <COMPOUND_NUMBER> (109)
WAY-300046

>  <BAR_CODE_NO> (109)
3902004

>  <LOCATION_CODE> (109)
PTNCS

>  <AMOUNT_CURRENT> (109)
33.1

$$$$
WAY-300063
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    0.9828    0.4414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1931   -0.3897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1793    0.6034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3483    0.4655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8862    1.8276    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4172   -0.1241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
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  3  7  1  0  0  0  0
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  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
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 10 14  2  0  0  0  0
 10 15  1  0  0  0  0
 12 16  2  0  0  0  0
 12 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 18 21  2  0  0  0  0
 20 22  1  0  0  0  0
  7  8  2  0  0  0  0
 11 13  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (110)
110

>  <Formula> (110)
C16H13N3O3

>  <MolWeight> (110)
295.29272

>  <PCAT_CMPD_ID> (110)
WAY-300063

>  <CNC_ID> (110)
359370737

>  <transfer_container_id> (110)
PTN000000070

>  <COMPOUND_NUMBER> (110)
WAY-300063

>  <BAR_CODE_NO> (110)
3902023

>  <LOCATION_CODE> (110)
PTNCS

>  <AMOUNT_CURRENT> (110)
33.3

$$$$
WAY-300072
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    3.1138    1.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4931    0.3759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3138    1.1966    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
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  9 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 19 21  2  0  0  0  0
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 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  6  8  1  0  0  0  0
 15 18  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (111)
111

>  <Formula> (111)
C19H20N2O3S

>  <MolWeight> (111)
356.4387

>  <PCAT_CMPD_ID> (111)
WAY-300072

>  <CNC_ID> (111)
359370746

>  <transfer_container_id> (111)
PTN000000070

>  <COMPOUND_NUMBER> (111)
WAY-300072

>  <BAR_CODE_NO> (111)
3902033

>  <LOCATION_CODE> (111)
PTNCS

>  <AMOUNT_CURRENT> (111)
33

$$$$
WAY-300093
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.3204    0.2950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3204    1.4778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
  5  7  1  0  0  0  0
  8 10  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (112)
112

>  <Formula> (112)
C13H13N5O2

>  <MolWeight> (112)
271.27462

>  <PCAT_CMPD_ID> (112)
WAY-300093

>  <CNC_ID> (112)
359370763

>  <transfer_container_id> (112)
PTN000000070

>  <COMPOUND_NUMBER> (112)
WAY-300093

>  <BAR_CODE_NO> (112)
3902058

>  <LOCATION_CODE> (112)
PTNCS

>  <AMOUNT_CURRENT> (112)
33.3

$$$$
WAY-300107
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -0.7724    0.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
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 17 21  1  0  0  0  0
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 19 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
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 13 15  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (113)
113

>  <Formula> (113)
C17H15ClN4O2S

>  <MolWeight> (113)
374.8446

>  <PCAT_CMPD_ID> (113)
WAY-300107

>  <CNC_ID> (113)
359370777

>  <transfer_container_id> (113)
PTN000000070

>  <COMPOUND_NUMBER> (113)
WAY-300107

>  <BAR_CODE_NO> (113)
3902076

>  <LOCATION_CODE> (113)
PTNCS

>  <AMOUNT_CURRENT> (113)
33.4

$$$$
WAY-300110
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.4241    2.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 15  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (114)
114

>  <Formula> (114)
C17H14N4O4S

>  <MolWeight> (114)
370.38246

>  <PCAT_CMPD_ID> (114)
WAY-300110

>  <CNC_ID> (114)
359370780

>  <transfer_container_id> (114)
PTN000000070

>  <COMPOUND_NUMBER> (114)
WAY-300110

>  <BAR_CODE_NO> (114)
3902079

>  <LOCATION_CODE> (114)
PTNCS

>  <AMOUNT_CURRENT> (114)
33.4

$$$$
WAY-300111
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 17 20  1  0  0  0  0
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 20 23  1  0  0  0  0
  5  7  2  0  0  0  0
 16 19  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (115)
115

>  <Formula> (115)
C16H13Cl2N3OS

>  <MolWeight> (115)
366.26492

>  <PCAT_CMPD_ID> (115)
WAY-300111

>  <CNC_ID> (115)
359370781

>  <transfer_container_id> (115)
PTN000000070

>  <COMPOUND_NUMBER> (115)
WAY-300111

>  <BAR_CODE_NO> (115)
3902080

>  <LOCATION_CODE> (115)
PTNCS

>  <AMOUNT_CURRENT> (115)
33.1

$$$$
WAY-300140
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
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 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
 16 17  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (116)
116

>  <Formula> (116)
C16H13N7O

>  <MolWeight> (116)
319.32072

>  <PCAT_CMPD_ID> (116)
WAY-300140

>  <CNC_ID> (116)
359370806

>  <transfer_container_id> (116)
PTN000000070

>  <COMPOUND_NUMBER> (116)
WAY-300140

>  <BAR_CODE_NO> (116)
3902115

>  <LOCATION_CODE> (116)
PTNCS

>  <AMOUNT_CURRENT> (116)
33

$$$$
WAY-300151
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 17 18  1  0  0  0  0
  7  9  1  0  0  0  0
  8 13  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (117)
117

>  <Formula> (117)
C13H18N4S

>  <MolWeight> (117)
262.37382

>  <PCAT_CMPD_ID> (117)
WAY-300151

>  <CNC_ID> (117)
359370815

>  <transfer_container_id> (117)
PTN000000070

>  <COMPOUND_NUMBER> (117)
WAY-300151

>  <BAR_CODE_NO> (117)
3902131

>  <LOCATION_CODE> (117)
PTNCS

>  <AMOUNT_CURRENT> (117)
33

$$$$
WAY-300161
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 16 20  1  0  0  0  0
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 25 28  1  0  0  0  0
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 22 25  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (118)
118

>  <Formula> (118)
C19H20F4N4O

>  <MolWeight> (118)
396.3819128

>  <PCAT_CMPD_ID> (118)
WAY-300161

>  <CNC_ID> (118)
359370825

>  <transfer_container_id> (118)
PTN000000070

>  <COMPOUND_NUMBER> (118)
WAY-300161

>  <BAR_CODE_NO> (118)
3902144

>  <LOCATION_CODE> (118)
PTNCS

>  <AMOUNT_CURRENT> (118)
33.5

$$$$
WAY-300163
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (119)
119

>  <Formula> (119)
C17H17NO4

>  <MolWeight> (119)
299.32118

>  <PCAT_CMPD_ID> (119)
WAY-300163

>  <CNC_ID> (119)
359370826

>  <transfer_container_id> (119)
PTN000000070

>  <COMPOUND_NUMBER> (119)
WAY-300163

>  <BAR_CODE_NO> (119)
3902148

>  <LOCATION_CODE> (119)
PTNCS

>  <AMOUNT_CURRENT> (119)
33.4

$$$$
WAY-300169
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (120)
120

>  <Formula> (120)
C21H13ClF3N5O4

>  <MolWeight> (120)
491.8072296

>  <PCAT_CMPD_ID> (120)
WAY-300169

>  <CNC_ID> (120)
359370831

>  <transfer_container_id> (120)
PTN000000070

>  <COMPOUND_NUMBER> (120)
WAY-300169

>  <BAR_CODE_NO> (120)
3902154

>  <LOCATION_CODE> (120)
PTNCS

>  <AMOUNT_CURRENT> (120)
33.5

$$$$
WAY-300173
csChFnd80/10111816222D

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 15  9  1  0  0  0  0
 16  5  1  0  0  0  0
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M  END
>  <Mol_ID> (121)
121

>  <Formula> (121)
C18H13N3O2

>  <MolWeight> (121)
303.31472

>  <PCAT_CMPD_ID> (121)
WAY-300173

>  <CNC_ID> (121)
359370834

>  <transfer_container_id> (121)
PTN000000070

>  <COMPOUND_NUMBER> (121)
WAY-300173

>  <BAR_CODE_NO> (121)
3902158

>  <LOCATION_CODE> (121)
PTNCS

>  <AMOUNT_CURRENT> (121)
33.3

$$$$
WAY-300177
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (122)
122

>  <Formula> (122)
C17H15FN2O2

>  <MolWeight> (122)
298.3116032

>  <PCAT_CMPD_ID> (122)
WAY-300177

>  <CNC_ID> (122)
359370837

>  <transfer_container_id> (122)
PTN000000070

>  <COMPOUND_NUMBER> (122)
WAY-300177

>  <BAR_CODE_NO> (122)
3902163

>  <LOCATION_CODE> (122)
PTNCS

>  <AMOUNT_CURRENT> (122)
33.3

$$$$
WAY-300183
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (123)
123

>  <Formula> (123)
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>  <MolWeight> (123)
337.41552

>  <PCAT_CMPD_ID> (123)
WAY-300183

>  <CNC_ID> (123)
359370841

>  <transfer_container_id> (123)
PTN000000070

>  <COMPOUND_NUMBER> (123)
WAY-300183

>  <BAR_CODE_NO> (123)
3902172

>  <LOCATION_CODE> (123)
PTNCS

>  <AMOUNT_CURRENT> (123)
33.3

$$$$
WAY-300184
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (124)
124

>  <Formula> (124)
C21H24N2O5S

>  <MolWeight> (124)
416.49066

>  <PCAT_CMPD_ID> (124)
WAY-300184

>  <CNC_ID> (124)
359370842

>  <transfer_container_id> (124)
PTN000000070

>  <COMPOUND_NUMBER> (124)
WAY-300184

>  <BAR_CODE_NO> (124)
3902173

>  <LOCATION_CODE> (124)
PTNCS

>  <AMOUNT_CURRENT> (124)
33.4

$$$$
WAY-300201
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (125)
125

>  <Formula> (125)
C15H20N2O3S

>  <MolWeight> (125)
308.3959

>  <PCAT_CMPD_ID> (125)
WAY-300201

>  <CNC_ID> (125)
359370854

>  <transfer_container_id> (125)
PTN000000070

>  <COMPOUND_NUMBER> (125)
WAY-300201

>  <BAR_CODE_NO> (125)
3902192

>  <LOCATION_CODE> (125)
PTNCS

>  <AMOUNT_CURRENT> (125)
30.1

$$$$
WAY-300223-A
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (126)
126

>  <Formula> (126)
C14H19BrN2OS

>  <MolWeight> (126)
343.28246

>  <PCAT_CMPD_ID> (126)
WAY-300223-A

>  <CNC_ID> (126)
359370876

>  <transfer_container_id> (126)
PTN000000070

>  <COMPOUND_NUMBER> (126)
WAY-300223-A

>  <BAR_CODE_NO> (126)
3902221

>  <LOCATION_CODE> (126)
PTNCS

>  <AMOUNT_CURRENT> (126)
33.3

$$$$
WAY-300226
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (127)
127

>  <Formula> (127)
C11H9NO4S2

>  <MolWeight> (127)
283.32346

>  <PCAT_CMPD_ID> (127)
WAY-300226

>  <CNC_ID> (127)
359370879

>  <transfer_container_id> (127)
PTN000000070

>  <COMPOUND_NUMBER> (127)
WAY-300226

>  <BAR_CODE_NO> (127)
3902226

>  <LOCATION_CODE> (127)
PTNCS

>  <AMOUNT_CURRENT> (127)
33.4

$$$$
WAY-300235
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (128)
128

>  <Formula> (128)
C23H20N2O4S

>  <MolWeight> (128)
420.4809

>  <PCAT_CMPD_ID> (128)
WAY-300235

>  <CNC_ID> (128)
359370888

>  <transfer_container_id> (128)
PTN000000070

>  <COMPOUND_NUMBER> (128)
WAY-300235

>  <BAR_CODE_NO> (128)
3902236

>  <LOCATION_CODE> (128)
PTNCS

>  <AMOUNT_CURRENT> (128)
33.3

$$$$
WAY-299711
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (129)
129

>  <Formula> (129)
C16H11ClN6OS

>  <MolWeight> (129)
370.81614

>  <PCAT_CMPD_ID> (129)
WAY-299711

>  <CNC_ID> (129)
359370388

>  <transfer_container_id> (129)
PTN000000070

>  <COMPOUND_NUMBER> (129)
WAY-299711

>  <BAR_CODE_NO> (129)
3901566

>  <LOCATION_CODE> (129)
PTNCS

>  <AMOUNT_CURRENT> (129)
33.5

$$$$
WAY-299717
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11  2  2  0  0  0  0
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 15  8  1  0  0  0  0
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 17  8  1  0  0  0  0
 18  5  1  0  0  0  0
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 20  4  1  0  0  0  0
 21  9  1  0  0  0  0
 22  9  1  0  0  0  0
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M  END
>  <Mol_ID> (130)
130

>  <Formula> (130)
C24H29N3O3

>  <MolWeight> (130)
407.50536

>  <PCAT_CMPD_ID> (130)
WAY-299717

>  <CNC_ID> (130)
359370394

>  <transfer_container_id> (130)
PTN000000070

>  <COMPOUND_NUMBER> (130)
WAY-299717

>  <BAR_CODE_NO> (130)
3901574

>  <LOCATION_CODE> (130)
PTNCS

>  <AMOUNT_CURRENT> (130)
33.1

$$$$
WAY-299719
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  1  0  0  0  0
 14 16  1  0  0  0  0
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 17 18  1  0  0  0  0
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M  END
>  <Mol_ID> (131)
131

>  <Formula> (131)
C13H22N6O

>  <MolWeight> (131)
278.35338

>  <PCAT_CMPD_ID> (131)
WAY-299719

>  <CNC_ID> (131)
359370396

>  <transfer_container_id> (131)
PTN000000070

>  <COMPOUND_NUMBER> (131)
WAY-299719

>  <BAR_CODE_NO> (131)
3901576

>  <LOCATION_CODE> (131)
PTNCS

>  <AMOUNT_CURRENT> (131)
33.2

$$$$
WAY-299720
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (132)
132

>  <Formula> (132)
C24H20BrNO6

>  <MolWeight> (132)
498.3227

>  <PCAT_CMPD_ID> (132)
WAY-299720

>  <CNC_ID> (132)
359370397

>  <transfer_container_id> (132)
PTN000000070

>  <COMPOUND_NUMBER> (132)
WAY-299720

>  <BAR_CODE_NO> (132)
3901577

>  <LOCATION_CODE> (132)
PTNCS

>  <AMOUNT_CURRENT> (132)
33.3

$$$$
WAY-299730
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (133)
133

>  <Formula> (133)
C14H15NO3S3

>  <MolWeight> (133)
341.4688

>  <PCAT_CMPD_ID> (133)
WAY-299730

>  <CNC_ID> (133)
359370407

>  <transfer_container_id> (133)
PTN000000070

>  <COMPOUND_NUMBER> (133)
WAY-299730

>  <BAR_CODE_NO> (133)
3901590

>  <LOCATION_CODE> (133)
PTNCS

>  <AMOUNT_CURRENT> (133)
33.4

$$$$
WAY-299738
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (134)
134

>  <Formula> (134)
C16H15BrN2O3

>  <MolWeight> (134)
363.2059

>  <PCAT_CMPD_ID> (134)
WAY-299738

>  <CNC_ID> (134)
359370415

>  <transfer_container_id> (134)
PTN000000070

>  <COMPOUND_NUMBER> (134)
WAY-299738

>  <BAR_CODE_NO> (134)
3901602

>  <LOCATION_CODE> (134)
PTNCS

>  <AMOUNT_CURRENT> (134)
33.5

$$$$
WAY-299766
csChFnd80/10111816222D

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 13 17  1  0  0  0  0
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 17 19  1  0  0  0  0
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 22 23  1  0  0  0  0
  5  9  1  0  0  0  0
 12 16  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (135)
135

>  <Formula> (135)
C17H13FN2O2S

>  <MolWeight> (135)
328.3607232

>  <PCAT_CMPD_ID> (135)
WAY-299766

>  <CNC_ID> (135)
359370443

>  <transfer_container_id> (135)
PTN000000070

>  <COMPOUND_NUMBER> (135)
WAY-299766

>  <BAR_CODE_NO> (135)
3901636

>  <LOCATION_CODE> (135)
PTNCS

>  <AMOUNT_CURRENT> (135)
33.2

$$$$
WAY-299777
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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 10 20  2  0  0  0  0
 14 21  1  0  0  0  0
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 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (136)
136

>  <Formula> (136)
C19H23ClO6

>  <MolWeight> (136)
382.83532

>  <PCAT_CMPD_ID> (136)
WAY-299777

>  <CNC_ID> (136)
359370454

>  <transfer_container_id> (136)
PTN000000070

>  <COMPOUND_NUMBER> (136)
WAY-299777

>  <BAR_CODE_NO> (136)
3901653

>  <LOCATION_CODE> (136)
PTNCS

>  <AMOUNT_CURRENT> (136)
33.1

$$$$
WAY-299785
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 13 20  1  0  0  0  0
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M  END
>  <Mol_ID> (137)
137

>  <Formula> (137)
C21H26N2O4

>  <MolWeight> (137)
370.44214

>  <PCAT_CMPD_ID> (137)
WAY-299785

>  <CNC_ID> (137)
359370462

>  <transfer_container_id> (137)
PTN000000070

>  <COMPOUND_NUMBER> (137)
WAY-299785

>  <BAR_CODE_NO> (137)
3901665

>  <LOCATION_CODE> (137)
PTNCS

>  <AMOUNT_CURRENT> (137)
33.2

$$$$
WAY-299788
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (138)
138

>  <Formula> (138)
C12H18N6O2

>  <MolWeight> (138)
278.31032

>  <PCAT_CMPD_ID> (138)
WAY-299788

>  <CNC_ID> (138)
359370465

>  <transfer_container_id> (138)
PTN000000070

>  <COMPOUND_NUMBER> (138)
WAY-299788

>  <BAR_CODE_NO> (138)
3901668

>  <LOCATION_CODE> (138)
PTNCS

>  <AMOUNT_CURRENT> (138)
33.3

$$$$
WAY-299804
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 18 17  2  0  0  0  0
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M  END
>  <Mol_ID> (139)
139

>  <Formula> (139)
C20H21N5O3

>  <MolWeight> (139)
379.41244

>  <PCAT_CMPD_ID> (139)
WAY-299804

>  <CNC_ID> (139)
359370481

>  <transfer_container_id> (139)
PTN000000070

>  <COMPOUND_NUMBER> (139)
WAY-299804

>  <BAR_CODE_NO> (139)
3901689

>  <LOCATION_CODE> (139)
PTNCS

>  <AMOUNT_CURRENT> (139)
33.3

$$$$
WAY-299818
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 13 19  2  0  0  0  0
M  END
>  <Mol_ID> (140)
140

>  <Formula> (140)
C15H14N4OS

>  <MolWeight> (140)
298.36286

>  <PCAT_CMPD_ID> (140)
WAY-299818

>  <CNC_ID> (140)
359370495

>  <transfer_container_id> (140)
PTN000000070

>  <COMPOUND_NUMBER> (140)
WAY-299818

>  <BAR_CODE_NO> (140)
3901707

>  <LOCATION_CODE> (140)
PTNCS

>  <AMOUNT_CURRENT> (140)
33.2

$$$$
WAY-299819
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (141)
141

>  <Formula> (141)
C12H10ClNOS

>  <MolWeight> (141)
251.7319

>  <PCAT_CMPD_ID> (141)
WAY-299819

>  <CNC_ID> (141)
359370496

>  <transfer_container_id> (141)
PTN000000070

>  <COMPOUND_NUMBER> (141)
WAY-299819

>  <BAR_CODE_NO> (141)
3901708

>  <LOCATION_CODE> (141)
PTNCS

>  <AMOUNT_CURRENT> (141)
33.3

$$$$
WAY-299821
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (142)
142

>  <Formula> (142)
C18H16N2O3

>  <MolWeight> (142)
308.33124

>  <PCAT_CMPD_ID> (142)
WAY-299821

>  <CNC_ID> (142)
359370498

>  <transfer_container_id> (142)
PTN000000070

>  <COMPOUND_NUMBER> (142)
WAY-299821

>  <BAR_CODE_NO> (142)
3901712

>  <LOCATION_CODE> (142)
PTNCS

>  <AMOUNT_CURRENT> (142)
33

$$$$
WAY-299834
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (143)
143

>  <Formula> (143)
C14H9ClN2O2S

>  <MolWeight> (143)
304.75146

>  <PCAT_CMPD_ID> (143)
WAY-299834

>  <CNC_ID> (143)
359370511

>  <transfer_container_id> (143)
PTN000000070

>  <COMPOUND_NUMBER> (143)
WAY-299834

>  <BAR_CODE_NO> (143)
3901727

>  <LOCATION_CODE> (143)
PTNCS

>  <AMOUNT_CURRENT> (143)
33.5

$$$$
WAY-299842
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (144)
144

>  <Formula> (144)
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>  <MolWeight> (144)
334.34706

>  <PCAT_CMPD_ID> (144)
WAY-299842

>  <CNC_ID> (144)
359370519

>  <transfer_container_id> (144)
PTN000000070

>  <COMPOUND_NUMBER> (144)
WAY-299842

>  <BAR_CODE_NO> (144)
3901737

>  <LOCATION_CODE> (144)
PTNCS

>  <AMOUNT_CURRENT> (144)
33.4

$$$$
WAY-299843-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (145)
145

>  <Formula> (145)
C14H20N2O3

>  <MolWeight> (145)
264.3202

>  <PCAT_CMPD_ID> (145)
WAY-299843-A

>  <CNC_ID> (145)
359370520

>  <transfer_container_id> (145)
PTN000000070

>  <COMPOUND_NUMBER> (145)
WAY-299843-A

>  <BAR_CODE_NO> (145)
3901740

>  <LOCATION_CODE> (145)
PTNCS

>  <AMOUNT_CURRENT> (145)
33.5

$$$$
WAY-299847
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (146)
146

>  <Formula> (146)
C27H21NO6

>  <MolWeight> (146)
455.45874

>  <PCAT_CMPD_ID> (146)
WAY-299847

>  <CNC_ID> (146)
359370524

>  <transfer_container_id> (146)
PTN000000070

>  <COMPOUND_NUMBER> (146)
WAY-299847

>  <BAR_CODE_NO> (146)
3901745

>  <LOCATION_CODE> (146)
PTNCS

>  <AMOUNT_CURRENT> (146)
33.3

$$$$
WAY-299851
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (147)
147

>  <Formula> (147)
C13H12BrNO

>  <MolWeight> (147)
278.14448

>  <PCAT_CMPD_ID> (147)
WAY-299851

>  <CNC_ID> (147)
359370528

>  <transfer_container_id> (147)
PTN000000070

>  <COMPOUND_NUMBER> (147)
WAY-299851

>  <BAR_CODE_NO> (147)
3901751

>  <LOCATION_CODE> (147)
PTNCS

>  <AMOUNT_CURRENT> (147)
33.5

$$$$
WAY-299857
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (148)
148

>  <Formula> (148)
C19H20N2O2S

>  <MolWeight> (148)
340.4393

>  <PCAT_CMPD_ID> (148)
WAY-299857

>  <CNC_ID> (148)
359370534

>  <transfer_container_id> (148)
PTN000000070

>  <COMPOUND_NUMBER> (148)
WAY-299857

>  <BAR_CODE_NO> (148)
3901762

>  <LOCATION_CODE> (148)
PTNCS

>  <AMOUNT_CURRENT> (148)
33.1

$$$$
WAY-299864
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (149)
149

>  <Formula> (149)
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327.80472

>  <PCAT_CMPD_ID> (149)
WAY-299864

>  <CNC_ID> (149)
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>  <transfer_container_id> (149)
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>  <COMPOUND_NUMBER> (149)
WAY-299864

>  <BAR_CODE_NO> (149)
3901772

>  <LOCATION_CODE> (149)
PTNCS

>  <AMOUNT_CURRENT> (149)
33.3

$$$$
WAY-299867
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (150)
150

>  <Formula> (150)
C16H25N5

>  <MolWeight> (150)
287.4032

>  <PCAT_CMPD_ID> (150)
WAY-299867

>  <CNC_ID> (150)
359370545

>  <transfer_container_id> (150)
PTN000000070

>  <COMPOUND_NUMBER> (150)
WAY-299867

>  <BAR_CODE_NO> (150)
3901775

>  <LOCATION_CODE> (150)
PTNCS

>  <AMOUNT_CURRENT> (150)
33.4

$$$$
WAY-299870
csChFnd80/10111816222D

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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (151)
151

>  <Formula> (151)
C18H23N3O2S

>  <MolWeight> (151)
345.45912

>  <PCAT_CMPD_ID> (151)
WAY-299870

>  <CNC_ID> (151)
359370548

>  <transfer_container_id> (151)
PTN000000070

>  <COMPOUND_NUMBER> (151)
WAY-299870

>  <BAR_CODE_NO> (151)
3901780

>  <LOCATION_CODE> (151)
PTNCS

>  <AMOUNT_CURRENT> (151)
33.3

$$$$
WAY-299873
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (152)
152

>  <Formula> (152)
C15H13N3O4S

>  <MolWeight> (152)
331.34642

>  <PCAT_CMPD_ID> (152)
WAY-299873

>  <CNC_ID> (152)
359370551

>  <transfer_container_id> (152)
PTN000000070

>  <COMPOUND_NUMBER> (152)
WAY-299873

>  <BAR_CODE_NO> (152)
3901784

>  <LOCATION_CODE> (152)
PTNCS

>  <AMOUNT_CURRENT> (152)
33.2

$$$$
WAY-299881
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (153)
153

>  <Formula> (153)
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>  <MolWeight> (153)
418.4122496

>  <PCAT_CMPD_ID> (153)
WAY-299881

>  <CNC_ID> (153)
359370559

>  <transfer_container_id> (153)
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>  <COMPOUND_NUMBER> (153)
WAY-299881

>  <BAR_CODE_NO> (153)
3901794

>  <LOCATION_CODE> (153)
PTNCS

>  <AMOUNT_CURRENT> (153)
33.3

$$$$
WAY-299884
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (154)
154

>  <Formula> (154)
C16H8ClNO2S

>  <MolWeight> (154)
313.75822

>  <PCAT_CMPD_ID> (154)
WAY-299884

>  <CNC_ID> (154)
359370562

>  <transfer_container_id> (154)
PTN000000070

>  <COMPOUND_NUMBER> (154)
WAY-299884

>  <BAR_CODE_NO> (154)
3901797

>  <LOCATION_CODE> (154)
PTNCS

>  <AMOUNT_CURRENT> (154)
33.4

$$$$
WAY-299885
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (155)
155

>  <Formula> (155)
C16H17ClN4O2S

>  <MolWeight> (155)
364.84978

>  <PCAT_CMPD_ID> (155)
WAY-299885

>  <CNC_ID> (155)
359370563

>  <transfer_container_id> (155)
PTN000000070

>  <COMPOUND_NUMBER> (155)
WAY-299885

>  <BAR_CODE_NO> (155)
3901798

>  <LOCATION_CODE> (155)
PTNCS

>  <AMOUNT_CURRENT> (155)
33

$$$$
WAY-299887
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
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 18 20  2  0  0  0  0
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 23 24  1  0  0  0  0
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 13 15  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (156)
156

>  <Formula> (156)
C17H15Cl2N3OS

>  <MolWeight> (156)
380.2915

>  <PCAT_CMPD_ID> (156)
WAY-299887

>  <CNC_ID> (156)
359370565

>  <transfer_container_id> (156)
PTN000000070

>  <COMPOUND_NUMBER> (156)
WAY-299887

>  <BAR_CODE_NO> (156)
3901801

>  <LOCATION_CODE> (156)
PTNCS

>  <AMOUNT_CURRENT> (156)
33.1

$$$$
WAY-299890
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  3  2  0  0  0  0
 13 11  2  0  0  0  0
 14  6  2  0  0  0  0
 15  6  1  0  0  0  0
 16 17  1  0  0  0  0
 17 19  2  0  0  0  0
 18  7  2  0  0  0  0
 19 11  1  0  0  0  0
 20 10  2  0  0  0  0
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 23 20  1  0  0  0  0
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 22 23  2  0  0  0  0
  8 16  2  0  0  0  0
M  END
>  <Mol_ID> (157)
157

>  <Formula> (157)
C17H15NO5

>  <MolWeight> (157)
313.3047

>  <PCAT_CMPD_ID> (157)
WAY-299890

>  <CNC_ID> (157)
359370568

>  <transfer_container_id> (157)
PTN000000070

>  <COMPOUND_NUMBER> (157)
WAY-299890

>  <BAR_CODE_NO> (157)
3901804

>  <LOCATION_CODE> (157)
PTNCS

>  <AMOUNT_CURRENT> (157)
33.1

$$$$
WAY-299893
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (158)
158

>  <Formula> (158)
C19H14N2O3S

>  <MolWeight> (158)
350.39106

>  <PCAT_CMPD_ID> (158)
WAY-299893

>  <CNC_ID> (158)
359370571

>  <transfer_container_id> (158)
PTN000000070

>  <COMPOUND_NUMBER> (158)
WAY-299893

>  <BAR_CODE_NO> (158)
3901808

>  <LOCATION_CODE> (158)
PTNCS

>  <AMOUNT_CURRENT> (158)
33.2

$$$$
WAY-299895
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (159)
159

>  <Formula> (159)
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>  <MolWeight> (159)
368.85994

>  <PCAT_CMPD_ID> (159)
WAY-299895

>  <CNC_ID> (159)
359370573

>  <transfer_container_id> (159)
PTN000000070

>  <COMPOUND_NUMBER> (159)
WAY-299895

>  <BAR_CODE_NO> (159)
3901811

>  <LOCATION_CODE> (159)
PTNCS

>  <AMOUNT_CURRENT> (159)
33.3

$$$$
WAY-299908
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (160)
160

>  <Formula> (160)
C16H13FO3

>  <MolWeight> (160)
272.2710232

>  <PCAT_CMPD_ID> (160)
WAY-299908

>  <CNC_ID> (160)
359370586

>  <transfer_container_id> (160)
PTN000000070

>  <COMPOUND_NUMBER> (160)
WAY-299908

>  <BAR_CODE_NO> (160)
3901827

>  <LOCATION_CODE> (160)
PTNCS

>  <AMOUNT_CURRENT> (160)
33.4

$$$$
WAY-299910
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (161)
161

>  <Formula> (161)
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>  <MolWeight> (161)
424.4912

>  <PCAT_CMPD_ID> (161)
WAY-299910

>  <CNC_ID> (161)
359370588

>  <transfer_container_id> (161)
PTN000000070

>  <COMPOUND_NUMBER> (161)
WAY-299910

>  <BAR_CODE_NO> (161)
3901829

>  <LOCATION_CODE> (161)
PTNCS

>  <AMOUNT_CURRENT> (161)
33.1

$$$$
WAY-299917
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (162)
162

>  <Formula> (162)
C15H11ClN2O

>  <MolWeight> (162)
270.71364

>  <PCAT_CMPD_ID> (162)
WAY-299917

>  <CNC_ID> (162)
359370595

>  <transfer_container_id> (162)
PTN000000070

>  <COMPOUND_NUMBER> (162)
WAY-299917

>  <BAR_CODE_NO> (162)
3901840

>  <LOCATION_CODE> (162)
PTNCS

>  <AMOUNT_CURRENT> (162)
33.1

$$$$
WAY-299950
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (163)
163

>  <Formula> (163)
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>  <MolWeight> (163)
269.29688

>  <PCAT_CMPD_ID> (163)
WAY-299950

>  <CNC_ID> (163)
359370628

>  <transfer_container_id> (163)
PTN000000070

>  <COMPOUND_NUMBER> (163)
WAY-299950

>  <BAR_CODE_NO> (163)
3901878

>  <LOCATION_CODE> (163)
PTNCS

>  <AMOUNT_CURRENT> (163)
33.2

$$$$
WAY-300283
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (164)
164

>  <Formula> (164)
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>  <MolWeight> (164)
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WAY-300283

>  <CNC_ID> (164)
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>  <transfer_container_id> (164)
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>  <COMPOUND_NUMBER> (164)
WAY-300283

>  <BAR_CODE_NO> (164)
3902297

>  <LOCATION_CODE> (164)
PTNCS

>  <AMOUNT_CURRENT> (164)
33.1

$$$$
WAY-300289
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (165)
165

>  <Formula> (165)
C18H17BrN2O2

>  <MolWeight> (165)
373.24378

>  <PCAT_CMPD_ID> (165)
WAY-300289

>  <CNC_ID> (165)
359370941

>  <transfer_container_id> (165)
PTN000000070

>  <COMPOUND_NUMBER> (165)
WAY-300289

>  <BAR_CODE_NO> (165)
3902307

>  <LOCATION_CODE> (165)
PTNCS

>  <AMOUNT_CURRENT> (165)
33.1

$$$$
WAY-300337
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (166)
166

>  <Formula> (166)
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>  <MolWeight> (166)
446.31764

>  <PCAT_CMPD_ID> (166)
WAY-300337

>  <CNC_ID> (166)
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>  <transfer_container_id> (166)
PTN000000070

>  <COMPOUND_NUMBER> (166)
WAY-300337

>  <BAR_CODE_NO> (166)
3902365

>  <LOCATION_CODE> (166)
PTNCS

>  <AMOUNT_CURRENT> (166)
33

$$$$
WAY-300342
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (167)
167

>  <Formula> (167)
C17H21N3O2S2

>  <MolWeight> (167)
363.49754

>  <PCAT_CMPD_ID> (167)
WAY-300342

>  <CNC_ID> (167)
359370991

>  <transfer_container_id> (167)
PTN000000070

>  <COMPOUND_NUMBER> (167)
WAY-300342

>  <BAR_CODE_NO> (167)
3902373

>  <LOCATION_CODE> (167)
PTNCS

>  <AMOUNT_CURRENT> (167)
33.2

$$$$
WAY-300362
csChFnd80/10111816222D

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>  <Mol_ID> (168)
168

>  <Formula> (168)
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>  <MolWeight> (168)
300.349

>  <PCAT_CMPD_ID> (168)
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>  <CNC_ID> (168)
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>  <transfer_container_id> (168)
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>  <COMPOUND_NUMBER> (168)
WAY-300362

>  <BAR_CODE_NO> (168)
3902405

>  <LOCATION_CODE> (168)
PTNCS

>  <AMOUNT_CURRENT> (168)
33.5

$$$$
WAY-300365
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (169)
169

>  <Formula> (169)
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>  <MolWeight> (169)
231.25052

>  <PCAT_CMPD_ID> (169)
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>  <CNC_ID> (169)
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>  <transfer_container_id> (169)
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>  <COMPOUND_NUMBER> (169)
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>  <BAR_CODE_NO> (169)
3902408

>  <LOCATION_CODE> (169)
PTNCS

>  <AMOUNT_CURRENT> (169)
33.1

$$$$
WAY-300406
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (170)
170

>  <Formula> (170)
C19H16N2O4S2

>  <MolWeight> (170)
400.47134

>  <PCAT_CMPD_ID> (170)
WAY-300406

>  <CNC_ID> (170)
359371049

>  <transfer_container_id> (170)
PTN000000070

>  <COMPOUND_NUMBER> (170)
WAY-300406

>  <BAR_CODE_NO> (170)
3902454

>  <LOCATION_CODE> (170)
PTNCS

>  <AMOUNT_CURRENT> (170)
33.4

$$$$
WAY-300437
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10 18  3  0  0  0  0
 13 19  1  0  0  0  0
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 16 20  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (171)
171

>  <Formula> (171)
C18H18N2O6

>  <MolWeight> (171)
358.34532

>  <PCAT_CMPD_ID> (171)
WAY-300437

>  <CNC_ID> (171)
359371080

>  <transfer_container_id> (171)
PTN000000070

>  <COMPOUND_NUMBER> (171)
WAY-300437

>  <BAR_CODE_NO> (171)
3902497

>  <LOCATION_CODE> (171)
PTNCS

>  <AMOUNT_CURRENT> (171)
33.3

$$$$
WAY-300460
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 11 16  1  0  0  0  0
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 22 24  1  0  0  0  0
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 12 16  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (172)
172

>  <Formula> (172)
C18H22N2O2S2

>  <MolWeight> (172)
362.50948

>  <PCAT_CMPD_ID> (172)
WAY-300460

>  <CNC_ID> (172)
359371103

>  <transfer_container_id> (172)
PTN000000070

>  <COMPOUND_NUMBER> (172)
WAY-300460

>  <BAR_CODE_NO> (172)
3902525

>  <LOCATION_CODE> (172)
PTNCS

>  <AMOUNT_CURRENT> (172)
33.2

$$$$
WAY-300486
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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M  END
>  <Mol_ID> (173)
173

>  <Formula> (173)
C15H15F6NO

>  <MolWeight> (173)
339.2761192

>  <PCAT_CMPD_ID> (173)
WAY-300486

>  <CNC_ID> (173)
359371129

>  <transfer_container_id> (173)
PTN000000070

>  <COMPOUND_NUMBER> (173)
WAY-300486

>  <BAR_CODE_NO> (173)
3902561

>  <LOCATION_CODE> (173)
PTNCS

>  <AMOUNT_CURRENT> (173)
33.1

$$$$
WAY-300488
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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 12  9  2  0  0  0  0
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 13  9  1  0  0  0  0
M  END
>  <Mol_ID> (174)
174

>  <Formula> (174)
C11H12N2S

>  <MolWeight> (174)
204.29138

>  <PCAT_CMPD_ID> (174)
WAY-300488

>  <CNC_ID> (174)
359371131

>  <transfer_container_id> (174)
PTN000000070

>  <COMPOUND_NUMBER> (174)
WAY-300488

>  <BAR_CODE_NO> (174)
3902563

>  <LOCATION_CODE> (174)
PTNCS

>  <AMOUNT_CURRENT> (174)
33.3

$$$$
WAY-300504
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (175)
175

>  <Formula> (175)
C17H18Cl3NO

>  <MolWeight> (175)
358.68992

>  <PCAT_CMPD_ID> (175)
WAY-300504

>  <CNC_ID> (175)
359371147

>  <transfer_container_id> (175)
PTN000000070

>  <COMPOUND_NUMBER> (175)
WAY-300504

>  <BAR_CODE_NO> (175)
3902589

>  <LOCATION_CODE> (175)
PTNCS

>  <AMOUNT_CURRENT> (175)
33.3

$$$$
WAY-300534
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (176)
176

>  <Formula> (176)
C20H17BrN2O3S2

>  <MolWeight> (176)
477.39458

>  <PCAT_CMPD_ID> (176)
WAY-300534

>  <CNC_ID> (176)
359371177

>  <transfer_container_id> (176)
PTN000000070

>  <COMPOUND_NUMBER> (176)
WAY-300534

>  <BAR_CODE_NO> (176)
3902631

>  <LOCATION_CODE> (176)
PTNCS

>  <AMOUNT_CURRENT> (176)
33.3

$$$$
WAY-300540
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 16  8  1  0  0  0  0
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 18  2  1  0  0  0  0
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M  END
>  <Mol_ID> (177)
177

>  <Formula> (177)
C20H19N3O4S

>  <MolWeight> (177)
397.44756

>  <PCAT_CMPD_ID> (177)
WAY-300540

>  <CNC_ID> (177)
359371183

>  <transfer_container_id> (177)
PRL000000080

>  <COMPOUND_NUMBER> (177)
WAY-300540

>  <BAR_CODE_NO> (177)
3932639

>  <LOCATION_CODE> (177)
PRLCS

>  <AMOUNT_CURRENT> (177)
33.3

$$$$
WAY-300581
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (178)
178

>  <Formula> (178)
C20H22N2O3

>  <MolWeight> (178)
338.40028

>  <PCAT_CMPD_ID> (178)
WAY-300581

>  <CNC_ID> (178)
359371224

>  <transfer_container_id> (178)
PTN000000070

>  <COMPOUND_NUMBER> (178)
WAY-300581

>  <BAR_CODE_NO> (178)
3902696

>  <LOCATION_CODE> (178)
PTNCS

>  <AMOUNT_CURRENT> (178)
33.2

$$$$
WAY-300597
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (179)
179

>  <Formula> (179)
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>  <MolWeight> (179)
342.36906

>  <PCAT_CMPD_ID> (179)
WAY-300597

>  <CNC_ID> (179)
359371240

>  <transfer_container_id> (179)
PTN000000070

>  <COMPOUND_NUMBER> (179)
WAY-300597

>  <BAR_CODE_NO> (179)
3902716

>  <LOCATION_CODE> (179)
PTNCS

>  <AMOUNT_CURRENT> (179)
33.1

$$$$
WAY-300599
csChFnd80/10111816222D

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 17 20  1  0  0  0  0
M  END
>  <Mol_ID> (180)
180

>  <Formula> (180)
C17H17NO4

>  <MolWeight> (180)
299.32118

>  <PCAT_CMPD_ID> (180)
WAY-300599

>  <CNC_ID> (180)
359371242

>  <transfer_container_id> (180)
PTN000000070

>  <COMPOUND_NUMBER> (180)
WAY-300599

>  <BAR_CODE_NO> (180)
3902718

>  <LOCATION_CODE> (180)
PTNCS

>  <AMOUNT_CURRENT> (180)
33

$$$$
WAY-300628
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 13  8  1  0  0  0  0
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 17 18  1  0  0  0  0
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 18 19  2  0  0  0  0
  2  3  1  0  0  0  0
 19 20  1  0  0  0  0
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 19 24  1  0  0  0  0
 11 12  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (181)
181

>  <Formula> (181)
C21H25NO2S

>  <MolWeight> (181)
355.4937

>  <PCAT_CMPD_ID> (181)
WAY-300628

>  <CNC_ID> (181)
359371271

>  <transfer_container_id> (181)
PTN000000070

>  <COMPOUND_NUMBER> (181)
WAY-300628

>  <BAR_CODE_NO> (181)
3902762

>  <LOCATION_CODE> (181)
PTNCS

>  <AMOUNT_CURRENT> (181)
33.2

$$$$
WAY-300633
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  4  1  0  0  0  0
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 15  7  1  0  0  0  0
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 16 18  2  0  0  0  0
M  END
>  <Mol_ID> (182)
182

>  <Formula> (182)
C11H11BrN2O3S

>  <MolWeight> (182)
331.18564

>  <PCAT_CMPD_ID> (182)
WAY-300633

>  <CNC_ID> (182)
359371276

>  <transfer_container_id> (182)
PTN000000070

>  <COMPOUND_NUMBER> (182)
WAY-300633

>  <BAR_CODE_NO> (182)
3902770

>  <LOCATION_CODE> (182)
PTNCS

>  <AMOUNT_CURRENT> (182)
33.1

$$$$
WAY-300659
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (183)
183

>  <Formula> (183)
C17H11ClO5

>  <MolWeight> (183)
330.71924

>  <PCAT_CMPD_ID> (183)
WAY-300659

>  <CNC_ID> (183)
359371302

>  <transfer_container_id> (183)
PTN000000070

>  <COMPOUND_NUMBER> (183)
WAY-300659

>  <BAR_CODE_NO> (183)
3902804

>  <LOCATION_CODE> (183)
PTNCS

>  <AMOUNT_CURRENT> (183)
33.1

$$$$
WAY-300662
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (184)
184

>  <Formula> (184)
C20H12Cl2N2O2S

>  <MolWeight> (184)
415.29248

>  <PCAT_CMPD_ID> (184)
WAY-300662

>  <CNC_ID> (184)
359371305

>  <transfer_container_id> (184)
PTN000000070

>  <COMPOUND_NUMBER> (184)
WAY-300662

>  <BAR_CODE_NO> (184)
3902807

>  <LOCATION_CODE> (184)
PTNCS

>  <AMOUNT_CURRENT> (184)
33.1

$$$$
WAY-300664
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (185)
185

>  <Formula> (185)
C12H12N2O3S

>  <MolWeight> (185)
264.30028

>  <PCAT_CMPD_ID> (185)
WAY-300664

>  <CNC_ID> (185)
359371307

>  <transfer_container_id> (185)
PTN000000070

>  <COMPOUND_NUMBER> (185)
WAY-300664

>  <BAR_CODE_NO> (185)
3902810

>  <LOCATION_CODE> (185)
PTNCS

>  <AMOUNT_CURRENT> (185)
33.4

$$$$
WAY-300675
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (186)
186

>  <Formula> (186)
C20H20N2O3

>  <MolWeight> (186)
336.3844

>  <PCAT_CMPD_ID> (186)
WAY-300675

>  <CNC_ID> (186)
359371318

>  <transfer_container_id> (186)
PTN000000070

>  <COMPOUND_NUMBER> (186)
WAY-300675

>  <BAR_CODE_NO> (186)
3902822

>  <LOCATION_CODE> (186)
PTNCS

>  <AMOUNT_CURRENT> (186)
33.2

$$$$
WAY-300682
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
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 15 16  2  0  0  0  0
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 17 20  2  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
 19 23  2  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (187)
187

>  <Formula> (187)
C15H14N2O5S

>  <MolWeight> (187)
334.34706

>  <PCAT_CMPD_ID> (187)
WAY-300682

>  <CNC_ID> (187)
359371325

>  <transfer_container_id> (187)
PTN000000070

>  <COMPOUND_NUMBER> (187)
WAY-300682

>  <BAR_CODE_NO> (187)
3902831

>  <LOCATION_CODE> (187)
PTNCS

>  <AMOUNT_CURRENT> (187)
33.2

$$$$
WAY-300684
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 12 16  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (188)
188

>  <Formula> (188)
C17H12ClFN2O2S

>  <MolWeight> (188)
362.8057832

>  <PCAT_CMPD_ID> (188)
WAY-300684

>  <CNC_ID> (188)
359371327

>  <transfer_container_id> (188)
PTN000000070

>  <COMPOUND_NUMBER> (188)
WAY-300684

>  <BAR_CODE_NO> (188)
3902833

>  <LOCATION_CODE> (188)
PTNCS

>  <AMOUNT_CURRENT> (188)
33

$$$$
WAY-300693
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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M  END
>  <Mol_ID> (189)
189

>  <Formula> (189)
C18H20N2O3S

>  <MolWeight> (189)
344.428

>  <PCAT_CMPD_ID> (189)
WAY-300693

>  <CNC_ID> (189)
359371336

>  <transfer_container_id> (189)
PTN000000070

>  <COMPOUND_NUMBER> (189)
WAY-300693

>  <BAR_CODE_NO> (189)
3902843

>  <LOCATION_CODE> (189)
PTNCS

>  <AMOUNT_CURRENT> (189)
33.5

$$$$
WAY-300697
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (190)
190

>  <Formula> (190)
C19H22N2O3S

>  <MolWeight> (190)
358.45458

>  <PCAT_CMPD_ID> (190)
WAY-300697

>  <CNC_ID> (190)
359371340

>  <transfer_container_id> (190)
PTN000000070

>  <COMPOUND_NUMBER> (190)
WAY-300697

>  <BAR_CODE_NO> (190)
3902848

>  <LOCATION_CODE> (190)
PTNCS

>  <AMOUNT_CURRENT> (190)
33.3

$$$$
WAY-300700
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  1  4  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
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 13 15  2  0  0  0  0
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 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
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  8 10  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (191)
191

>  <Formula> (191)
C19H22N2O2

>  <MolWeight> (191)
310.39018

>  <PCAT_CMPD_ID> (191)
WAY-300700

>  <CNC_ID> (191)
359371343

>  <transfer_container_id> (191)
PTN000000070

>  <COMPOUND_NUMBER> (191)
WAY-300700

>  <BAR_CODE_NO> (191)
3902852

>  <LOCATION_CODE> (191)
PTNCS

>  <AMOUNT_CURRENT> (191)
33.2

$$$$
WAY-300719
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  9  2  0  0  0  0
 12  9  1  0  0  0  0
 13  5  2  0  0  0  0
 14  3  1  0  0  0  0
 15  4  1  0  0  0  0
 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
 18 19  1  0  0  0  0
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M  END
>  <Mol_ID> (192)
192

>  <Formula> (192)
C19H20N4O3

>  <MolWeight> (192)
352.3871

>  <PCAT_CMPD_ID> (192)
WAY-300719

>  <CNC_ID> (192)
359371362

>  <transfer_container_id> (192)
PTN000000070

>  <COMPOUND_NUMBER> (192)
WAY-300719

>  <BAR_CODE_NO> (192)
3902887

>  <LOCATION_CODE> (192)
PTNCS

>  <AMOUNT_CURRENT> (192)
33.2

$$$$
WAY-300726
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (193)
193

>  <Formula> (193)
C13H13NO3

>  <MolWeight> (193)
231.24722

>  <PCAT_CMPD_ID> (193)
WAY-300726

>  <CNC_ID> (193)
359371369

>  <transfer_container_id> (193)
PTN000000070

>  <COMPOUND_NUMBER> (193)
WAY-300726

>  <BAR_CODE_NO> (193)
3902899

>  <LOCATION_CODE> (193)
PTNCS

>  <AMOUNT_CURRENT> (193)
33.2

$$$$
WAY-300736
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (194)
194

>  <Formula> (194)
C13H8FN3O

>  <MolWeight> (194)
241.2205232

>  <PCAT_CMPD_ID> (194)
WAY-300736

>  <CNC_ID> (194)
359371378

>  <transfer_container_id> (194)
PTN000000070

>  <COMPOUND_NUMBER> (194)
WAY-300736

>  <BAR_CODE_NO> (194)
3902911

>  <LOCATION_CODE> (194)
PTNCS

>  <AMOUNT_CURRENT> (194)
33.4

$$$$
WAY-300744
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (195)
195

>  <Formula> (195)
C14H12Cl2N2O2S

>  <MolWeight> (195)
343.22828

>  <PCAT_CMPD_ID> (195)
WAY-300744

>  <CNC_ID> (195)
359371386

>  <transfer_container_id> (195)
PTN000000070

>  <COMPOUND_NUMBER> (195)
WAY-300744

>  <BAR_CODE_NO> (195)
3902924

>  <LOCATION_CODE> (195)
PTNCS

>  <AMOUNT_CURRENT> (195)
33.3

$$$$
WAY-300753
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (196)
196

>  <Formula> (196)
C21H15F3N4O2

>  <MolWeight> (196)
412.3646096

>  <PCAT_CMPD_ID> (196)
WAY-300753

>  <CNC_ID> (196)
359371394

>  <transfer_container_id> (196)
PTN000000070

>  <COMPOUND_NUMBER> (196)
WAY-300753

>  <BAR_CODE_NO> (196)
3902935

>  <LOCATION_CODE> (196)
PTNCS

>  <AMOUNT_CURRENT> (196)
33.1

$$$$
WAY-300758
csChFnd80/10111816222D

 34 40  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (197)
197

>  <Formula> (197)
C26H20N2O6

>  <MolWeight> (197)
456.4468

>  <PCAT_CMPD_ID> (197)
WAY-300758

>  <CNC_ID> (197)
359371399

>  <transfer_container_id> (197)
PTN000000070

>  <COMPOUND_NUMBER> (197)
WAY-300758

>  <BAR_CODE_NO> (197)
3902940

>  <LOCATION_CODE> (197)
PTNCS

>  <AMOUNT_CURRENT> (197)
33.2

$$$$
WAY-300763
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (198)
198

>  <Formula> (198)
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>  <MolWeight> (198)
450.28474

>  <PCAT_CMPD_ID> (198)
WAY-300763

>  <CNC_ID> (198)
359371404

>  <transfer_container_id> (198)
PTN000000070

>  <COMPOUND_NUMBER> (198)
WAY-300763

>  <BAR_CODE_NO> (198)
3902945

>  <LOCATION_CODE> (198)
PTNCS

>  <AMOUNT_CURRENT> (198)
33.4

$$$$
WAY-300769
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (199)
199

>  <Formula> (199)
C17H15N3O3S

>  <MolWeight> (199)
341.3843

>  <PCAT_CMPD_ID> (199)
WAY-300769

>  <CNC_ID> (199)
359371410

>  <transfer_container_id> (199)
PTN000000070

>  <COMPOUND_NUMBER> (199)
WAY-300769

>  <BAR_CODE_NO> (199)
3902952

>  <LOCATION_CODE> (199)
PTNCS

>  <AMOUNT_CURRENT> (199)
33.4

$$$$
WAY-300770
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (200)
200

>  <Formula> (200)
C19H23N3OS2

>  <MolWeight> (200)
373.53542

>  <PCAT_CMPD_ID> (200)
WAY-300770

>  <CNC_ID> (200)
359371411

>  <transfer_container_id> (200)
PTN000000070

>  <COMPOUND_NUMBER> (200)
WAY-300770

>  <BAR_CODE_NO> (200)
3902953

>  <LOCATION_CODE> (200)
PTNCS

>  <AMOUNT_CURRENT> (200)
33.2

$$$$
WAY-300777
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (201)
201

>  <Formula> (201)
C21H30N4O2

>  <MolWeight> (201)
370.4885

>  <PCAT_CMPD_ID> (201)
WAY-300777

>  <CNC_ID> (201)
359371418

>  <transfer_container_id> (201)
PTN000000070

>  <COMPOUND_NUMBER> (201)
WAY-300777

>  <BAR_CODE_NO> (201)
3902962

>  <LOCATION_CODE> (201)
PTNCS

>  <AMOUNT_CURRENT> (201)
33.3

$$$$
WAY-300783
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (202)
202

>  <Formula> (202)
C20H20N2O4

>  <MolWeight> (202)
352.3838

>  <PCAT_CMPD_ID> (202)
WAY-300783

>  <CNC_ID> (202)
359371423

>  <transfer_container_id> (202)
PTN000000070

>  <COMPOUND_NUMBER> (202)
WAY-300783

>  <BAR_CODE_NO> (202)
3902971

>  <LOCATION_CODE> (202)
PTNCS

>  <AMOUNT_CURRENT> (202)
33.5

$$$$
WAY-300784
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (203)
203

>  <Formula> (203)
C23H21N3O4S

>  <MolWeight> (203)
435.49554

>  <PCAT_CMPD_ID> (203)
WAY-300784

>  <CNC_ID> (203)
359371424

>  <transfer_container_id> (203)
PTN000000070

>  <COMPOUND_NUMBER> (203)
WAY-300784

>  <BAR_CODE_NO> (203)
3902972

>  <LOCATION_CODE> (203)
PTNCS

>  <AMOUNT_CURRENT> (203)
33.3

$$$$
WAY-300856
csChFnd80/10111816222D

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 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
M  END
>  <Mol_ID> (204)
204

>  <Formula> (204)
C22H19N3OS

>  <MolWeight> (204)
373.47076

>  <PCAT_CMPD_ID> (204)
WAY-300856

>  <CNC_ID> (204)
359371434

>  <transfer_container_id> (204)
PTN000000070

>  <COMPOUND_NUMBER> (204)
WAY-300856

>  <BAR_CODE_NO> (204)
3903075

>  <LOCATION_CODE> (204)
PTNCS

>  <AMOUNT_CURRENT> (204)
30.4

$$$$
WAY-301072
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 22 25  1  0  0  0  0
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M  END
>  <Mol_ID> (205)
205

>  <Formula> (205)
C23H21FN2O

>  <MolWeight> (205)
360.4240432

>  <PCAT_CMPD_ID> (205)
WAY-301072

>  <CNC_ID> (205)
359371448

>  <transfer_container_id> (205)
PTN000000070

>  <COMPOUND_NUMBER> (205)
WAY-301072

>  <BAR_CODE_NO> (205)
3903390

>  <LOCATION_CODE> (205)
PTNCS

>  <AMOUNT_CURRENT> (205)
25.1

$$$$
WAY-301117
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 10 13  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (206)
206

>  <Formula> (206)
C14H12Cl2N2O2S

>  <MolWeight> (206)
343.22828

>  <PCAT_CMPD_ID> (206)
WAY-301117

>  <CNC_ID> (206)
359371456

>  <transfer_container_id> (206)
PTN000000070

>  <COMPOUND_NUMBER> (206)
WAY-301117

>  <BAR_CODE_NO> (206)
3903449

>  <LOCATION_CODE> (206)
PTNCS

>  <AMOUNT_CURRENT> (206)
33.4

$$$$
WAY-301123
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (207)
207

>  <Formula> (207)
C17H17Cl2F3N4O2

>  <MolWeight> (207)
437.2436896

>  <PCAT_CMPD_ID> (207)
WAY-301123

>  <CNC_ID> (207)
359371462

>  <transfer_container_id> (207)
PTN000000070

>  <COMPOUND_NUMBER> (207)
WAY-301123

>  <BAR_CODE_NO> (207)
3903458

>  <LOCATION_CODE> (207)
PTNCS

>  <AMOUNT_CURRENT> (207)
33.5

$$$$
WAY-301124
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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 10 11  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (208)
208

>  <Formula> (208)
C15H9Cl3N2OS

>  <MolWeight> (208)
371.66876

>  <PCAT_CMPD_ID> (208)
WAY-301124

>  <CNC_ID> (208)
359371463

>  <transfer_container_id> (208)
PTN000000070

>  <COMPOUND_NUMBER> (208)
WAY-301124

>  <BAR_CODE_NO> (208)
3903459

>  <LOCATION_CODE> (208)
PTNCS

>  <AMOUNT_CURRENT> (208)
33.3

$$$$
WAY-301125
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (209)
209

>  <Formula> (209)
C22H14N4O2

>  <MolWeight> (209)
366.37216

>  <PCAT_CMPD_ID> (209)
WAY-301125

>  <CNC_ID> (209)
359371464

>  <transfer_container_id> (209)
PTN000000070

>  <COMPOUND_NUMBER> (209)
WAY-301125

>  <BAR_CODE_NO> (209)
3903460

>  <LOCATION_CODE> (209)
PTNCS

>  <AMOUNT_CURRENT> (209)
33.4

$$$$
WAY-301126
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 13 18  1  0  0  0  0
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 20 23  1  0  0  0  0
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M  END
>  <Mol_ID> (210)
210

>  <Formula> (210)
C19H21BrN2O3S

>  <MolWeight> (210)
437.35064

>  <PCAT_CMPD_ID> (210)
WAY-301126

>  <CNC_ID> (210)
359371465

>  <transfer_container_id> (210)
PTN000000070

>  <COMPOUND_NUMBER> (210)
WAY-301126

>  <BAR_CODE_NO> (210)
3903462

>  <LOCATION_CODE> (210)
PTNCS

>  <AMOUNT_CURRENT> (210)
33.3

$$$$
WAY-301145
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 22 24  2  0  0  0  0
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 17 19  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (211)
211

>  <Formula> (211)
C18H14N4O2

>  <MolWeight> (211)
318.32936

>  <PCAT_CMPD_ID> (211)
WAY-301145

>  <CNC_ID> (211)
359371484

>  <transfer_container_id> (211)
PTN000000070

>  <COMPOUND_NUMBER> (211)
WAY-301145

>  <BAR_CODE_NO> (211)
3903488

>  <LOCATION_CODE> (211)
PTNCS

>  <AMOUNT_CURRENT> (211)
33.5

$$$$
WAY-301155
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 22 23  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (212)
212

>  <Formula> (212)
C19H16N2O4S2

>  <MolWeight> (212)
400.47134

>  <PCAT_CMPD_ID> (212)
WAY-301155

>  <CNC_ID> (212)
359371494

>  <transfer_container_id> (212)
PTN000000070

>  <COMPOUND_NUMBER> (212)
WAY-301155

>  <BAR_CODE_NO> (212)
3903500

>  <LOCATION_CODE> (212)
PTNCS

>  <AMOUNT_CURRENT> (212)
33.2

$$$$
WAY-301159
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 10 12  2  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (213)
213

>  <Formula> (213)
C13H10N2OS

>  <MolWeight> (213)
242.2963

>  <PCAT_CMPD_ID> (213)
WAY-301159

>  <CNC_ID> (213)
359371498

>  <transfer_container_id> (213)
PTN000000070

>  <COMPOUND_NUMBER> (213)
WAY-301159

>  <BAR_CODE_NO> (213)
3903505

>  <LOCATION_CODE> (213)
PTNCS

>  <AMOUNT_CURRENT> (213)
33.2

$$$$
WAY-301161
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -2.7515   -0.2651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1998   -1.2824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0243    2.2556    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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  1  4  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
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 13 15  1  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (214)
214

>  <Formula> (214)
C15H14ClN3

>  <MolWeight> (214)
271.74476

>  <PCAT_CMPD_ID> (214)
WAY-301161

>  <CNC_ID> (214)
359371500

>  <transfer_container_id> (214)
PTN000000070

>  <COMPOUND_NUMBER> (214)
WAY-301161

>  <BAR_CODE_NO> (214)
3903511

>  <LOCATION_CODE> (214)
PTNCS

>  <AMOUNT_CURRENT> (214)
33.1

$$$$
WAY-301188
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.5138    0.8759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
  7 14  2  0  0  0  0
 11 15  2  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 17 21  1  0  0  0  0
  5  9  1  0  0  0  0
 12 15  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (215)
215

>  <Formula> (215)
C15H11N3O3

>  <MolWeight> (215)
281.26614

>  <PCAT_CMPD_ID> (215)
WAY-301188

>  <CNC_ID> (215)
359371527

>  <transfer_container_id> (215)
PTN000000070

>  <COMPOUND_NUMBER> (215)
WAY-301188

>  <BAR_CODE_NO> (215)
3903546

>  <LOCATION_CODE> (215)
PTNCS

>  <AMOUNT_CURRENT> (215)
33.2

$$$$
WAY-301189
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  4  1  0  0  0  0
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  8 11  1  0  0  0  0
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  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (216)
216

>  <Formula> (216)
C15H13F3N4OS

>  <MolWeight> (216)
354.3501296

>  <PCAT_CMPD_ID> (216)
WAY-301189

>  <CNC_ID> (216)
359371528

>  <transfer_container_id> (216)
PTN000000070

>  <COMPOUND_NUMBER> (216)
WAY-301189

>  <BAR_CODE_NO> (216)
3903547

>  <LOCATION_CODE> (216)
PTNCS

>  <AMOUNT_CURRENT> (216)
33.3

$$$$
WAY-301190
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.6483    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
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 16 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
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  5  8  1  0  0  0  0
 15 17  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (217)
217

>  <Formula> (217)
C19H16N2O3S2

>  <MolWeight> (217)
384.47194

>  <PCAT_CMPD_ID> (217)
WAY-301190

>  <CNC_ID> (217)
359371529

>  <transfer_container_id> (217)
PTN000000070

>  <COMPOUND_NUMBER> (217)
WAY-301190

>  <BAR_CODE_NO> (217)
3903549

>  <LOCATION_CODE> (217)
PTNCS

>  <AMOUNT_CURRENT> (217)
33.2

$$$$
WAY-301203
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
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 11 12  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (218)
218

>  <Formula> (218)
C19H18N2O2S2

>  <MolWeight> (218)
370.48842

>  <PCAT_CMPD_ID> (218)
WAY-301203

>  <CNC_ID> (218)
359371542

>  <transfer_container_id> (218)
PTN000000070

>  <COMPOUND_NUMBER> (218)
WAY-301203

>  <BAR_CODE_NO> (218)
3903562

>  <LOCATION_CODE> (218)
PTNCS

>  <AMOUNT_CURRENT> (218)
33.2

$$$$
WAY-301205
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 11 16  1  0  0  0  0
M  END
>  <Mol_ID> (219)
219

>  <Formula> (219)
C16H20N2O2S2

>  <MolWeight> (219)
336.4722

>  <PCAT_CMPD_ID> (219)
WAY-301205

>  <CNC_ID> (219)
359371544

>  <transfer_container_id> (219)
PTN000000070

>  <COMPOUND_NUMBER> (219)
WAY-301205

>  <BAR_CODE_NO> (219)
3903564

>  <LOCATION_CODE> (219)
PTNCS

>  <AMOUNT_CURRENT> (219)
33.2

$$$$
WAY-301215
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
  7 10  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (220)
220

>  <Formula> (220)
C14H14N4O2S

>  <MolWeight> (220)
302.35156

>  <PCAT_CMPD_ID> (220)
WAY-301215

>  <CNC_ID> (220)
359371554

>  <transfer_container_id> (220)
PTN000000070

>  <COMPOUND_NUMBER> (220)
WAY-301215

>  <BAR_CODE_NO> (220)
3903575

>  <LOCATION_CODE> (220)
PTNCS

>  <AMOUNT_CURRENT> (220)
33.4

$$$$
WAY-301222
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 14  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (221)
221

>  <Formula> (221)
C20H22F3N3OS

>  <MolWeight> (221)
409.4683896

>  <PCAT_CMPD_ID> (221)
WAY-301222

>  <CNC_ID> (221)
359371561

>  <transfer_container_id> (221)
PTN000000070

>  <COMPOUND_NUMBER> (221)
WAY-301222

>  <BAR_CODE_NO> (221)
3903584

>  <LOCATION_CODE> (221)
PTNCS

>  <AMOUNT_CURRENT> (221)
33.5

$$$$
WAY-301225
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (222)
222

>  <Formula> (222)
C8H14N4O4

>  <MolWeight> (222)
230.22116

>  <PCAT_CMPD_ID> (222)
WAY-301225

>  <CNC_ID> (222)
359371564

>  <transfer_container_id> (222)
PTN000000070

>  <COMPOUND_NUMBER> (222)
WAY-301225

>  <BAR_CODE_NO> (222)
3903587

>  <LOCATION_CODE> (222)
PTNCS

>  <AMOUNT_CURRENT> (222)
33

$$$$
WAY-301227
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
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M  END
>  <Mol_ID> (223)
223

>  <Formula> (223)
C23H19ClN4O4S

>  <MolWeight> (223)
482.93936

>  <PCAT_CMPD_ID> (223)
WAY-301227

>  <CNC_ID> (223)
359371566

>  <transfer_container_id> (223)
PTN000000070

>  <COMPOUND_NUMBER> (223)
WAY-301227

>  <BAR_CODE_NO> (223)
3903589

>  <LOCATION_CODE> (223)
PTNCS

>  <AMOUNT_CURRENT> (223)
33.4

$$$$
WAY-301233
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (224)
224

>  <Formula> (224)
C17H16N2O3

>  <MolWeight> (224)
296.32054

>  <PCAT_CMPD_ID> (224)
WAY-301233

>  <CNC_ID> (224)
359371572

>  <transfer_container_id> (224)
PTN000000070

>  <COMPOUND_NUMBER> (224)
WAY-301233

>  <BAR_CODE_NO> (224)
3903599

>  <LOCATION_CODE> (224)
PTNCS

>  <AMOUNT_CURRENT> (224)
33.1

$$$$
WAY-301240
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (225)
225

>  <Formula> (225)
C13H13NO2

>  <MolWeight> (225)
215.24782

>  <PCAT_CMPD_ID> (225)
WAY-301240

>  <CNC_ID> (225)
359371579

>  <transfer_container_id> (225)
PTN000000070

>  <COMPOUND_NUMBER> (225)
WAY-301240

>  <BAR_CODE_NO> (225)
3903606

>  <LOCATION_CODE> (225)
PTNCS

>  <AMOUNT_CURRENT> (225)
33.1

$$$$
WAY-301244
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (226)
226

>  <Formula> (226)
C26H30N4O3

>  <MolWeight> (226)
446.5414

>  <PCAT_CMPD_ID> (226)
WAY-301244

>  <CNC_ID> (226)
359371583

>  <transfer_container_id> (226)
PTN000000070

>  <COMPOUND_NUMBER> (226)
WAY-301244

>  <BAR_CODE_NO> (226)
3903615

>  <LOCATION_CODE> (226)
PTNCS

>  <AMOUNT_CURRENT> (226)
33.5

$$$$
WAY-301248
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (227)
227

>  <Formula> (227)
C24H25N3O4

>  <MolWeight> (227)
419.473

>  <PCAT_CMPD_ID> (227)
WAY-301248

>  <CNC_ID> (227)
359371587

>  <transfer_container_id> (227)
PTN000000070

>  <COMPOUND_NUMBER> (227)
WAY-301248

>  <BAR_CODE_NO> (227)
3903619

>  <LOCATION_CODE> (227)
PTNCS

>  <AMOUNT_CURRENT> (227)
33.2

$$$$
WAY-301251
csChFnd80/10111816222D

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 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
 13 21  1  0  0  0  0
 15 22  1  0  0  0  0
 18 23  1  0  0  0  0
 18 24  1  0  0  0  0
 20 25  2  0  0  0  0
 21 26  2  0  0  0  0
 22 27  1  0  0  0  0
 22 28  1  0  0  0  0
  7 12  1  0  0  0  0
 11 13  2  0  0  0  0
 16 22  1  0  0  0  0
 19 23  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (228)
228

>  <Formula> (228)
C25H23NO2

>  <MolWeight> (228)
369.45562

>  <PCAT_CMPD_ID> (228)
WAY-301251

>  <CNC_ID> (228)
359371590

>  <transfer_container_id> (228)
PTN000000070

>  <COMPOUND_NUMBER> (228)
WAY-301251

>  <BAR_CODE_NO> (228)
3903623

>  <LOCATION_CODE> (228)
PTNCS

>  <AMOUNT_CURRENT> (228)
33.1

$$$$
WAY-301273
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    0.4348   -1.4931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9445   -1.4931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  9 12  2  0  0  0  0
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 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 20 22  2  0  0  0  0
  7  8  1  0  0  0  0
 10 12  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (229)
229

>  <Formula> (229)
C16H16N4O2

>  <MolWeight> (229)
296.32384

>  <PCAT_CMPD_ID> (229)
WAY-301273

>  <CNC_ID> (229)
359371612

>  <transfer_container_id> (229)
PTN000000070

>  <COMPOUND_NUMBER> (229)
WAY-301273

>  <BAR_CODE_NO> (229)
3903660

>  <LOCATION_CODE> (229)
PTNCS

>  <AMOUNT_CURRENT> (229)
33

$$$$
WAY-301274
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 13 15  1  0  0  0  0
  7 10  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (230)
230

>  <Formula> (230)
C12H17NOS

>  <MolWeight> (230)
223.33448

>  <PCAT_CMPD_ID> (230)
WAY-301274

>  <CNC_ID> (230)
359371613

>  <transfer_container_id> (230)
PTN000000070

>  <COMPOUND_NUMBER> (230)
WAY-301274

>  <BAR_CODE_NO> (230)
3903661

>  <LOCATION_CODE> (230)
PTNCS

>  <AMOUNT_CURRENT> (230)
33.2

$$$$
WAY-301300
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.4931    0.4414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2207    0.8552    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4828   -0.3862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 10 15  1  0  0  0  0
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  9 13  2  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (231)
231

>  <Formula> (231)
C16H17NO4

>  <MolWeight> (231)
287.31048

>  <PCAT_CMPD_ID> (231)
WAY-301300

>  <CNC_ID> (231)
359371639

>  <transfer_container_id> (231)
PTN000000070

>  <COMPOUND_NUMBER> (231)
WAY-301300

>  <BAR_CODE_NO> (231)
3903695

>  <LOCATION_CODE> (231)
PTNCS

>  <AMOUNT_CURRENT> (231)
33.3

$$$$
WAY-301303
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 18 20  2  0  0  0  0
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 20 22  1  0  0  0  0
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  8  9  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (232)
232

>  <Formula> (232)
C18H19NO3

>  <MolWeight> (232)
297.34836

>  <PCAT_CMPD_ID> (232)
WAY-301303

>  <CNC_ID> (232)
359371642

>  <transfer_container_id> (232)
PTN000000070

>  <COMPOUND_NUMBER> (232)
WAY-301303

>  <BAR_CODE_NO> (232)
3903699

>  <LOCATION_CODE> (232)
PTNCS

>  <AMOUNT_CURRENT> (232)
33.1

$$$$
WAY-301313
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 22 23  2  0  0  0  0
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M  END
>  <Mol_ID> (233)
233

>  <Formula> (233)
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436.3844696

>  <PCAT_CMPD_ID> (233)
WAY-301313

>  <CNC_ID> (233)
359371652

>  <transfer_container_id> (233)
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>  <COMPOUND_NUMBER> (233)
WAY-301313

>  <BAR_CODE_NO> (233)
3903710

>  <LOCATION_CODE> (233)
PTNCS

>  <AMOUNT_CURRENT> (233)
33.3

$$$$
WAY-301324
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (234)
234

>  <Formula> (234)
C17H14N2O3

>  <MolWeight> (234)
294.30466

>  <PCAT_CMPD_ID> (234)
WAY-301324

>  <CNC_ID> (234)
359371663

>  <transfer_container_id> (234)
PTN000000070

>  <COMPOUND_NUMBER> (234)
WAY-301324

>  <BAR_CODE_NO> (234)
3903725

>  <LOCATION_CODE> (234)
PTNCS

>  <AMOUNT_CURRENT> (234)
33.3

$$$$
WAY-301337
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 22 25  1  0  0  0  0
 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (235)
235

>  <Formula> (235)
C21H16ClN3O2S2

>  <MolWeight> (235)
441.95364

>  <PCAT_CMPD_ID> (235)
WAY-301337

>  <CNC_ID> (235)
359371675

>  <transfer_container_id> (235)
PTN000000070

>  <COMPOUND_NUMBER> (235)
WAY-301337

>  <BAR_CODE_NO> (235)
3903744

>  <LOCATION_CODE> (235)
PTNCS

>  <AMOUNT_CURRENT> (235)
33.2

$$$$
WAY-301346
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (236)
236

>  <Formula> (236)
C13H14N4O4S2

>  <MolWeight> (236)
354.40466

>  <PCAT_CMPD_ID> (236)
WAY-301346

>  <CNC_ID> (236)
359371684

>  <transfer_container_id> (236)
PTN000000070

>  <COMPOUND_NUMBER> (236)
WAY-301346

>  <BAR_CODE_NO> (236)
3903754

>  <LOCATION_CODE> (236)
PTNCS

>  <AMOUNT_CURRENT> (236)
33.3

$$$$
WAY-301355
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (237)
237

>  <Formula> (237)
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>  <MolWeight> (237)
248.27774

>  <PCAT_CMPD_ID> (237)
WAY-301355

>  <CNC_ID> (237)
359371693

>  <transfer_container_id> (237)
PTN000000070

>  <COMPOUND_NUMBER> (237)
WAY-301355

>  <BAR_CODE_NO> (237)
3903766

>  <LOCATION_CODE> (237)
PTNCS

>  <AMOUNT_CURRENT> (237)
33.3

$$$$
WAY-301357
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (238)
238

>  <Formula> (238)
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>  <MolWeight> (238)
274.3613

>  <PCAT_CMPD_ID> (238)
WAY-301357

>  <CNC_ID> (238)
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>  <transfer_container_id> (238)
PTN000000070

>  <COMPOUND_NUMBER> (238)
WAY-301357

>  <BAR_CODE_NO> (238)
3903768

>  <LOCATION_CODE> (238)
PTNCS

>  <AMOUNT_CURRENT> (238)
33.1

$$$$
WAY-301366
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (239)
239

>  <Formula> (239)
C18H18N2O6S

>  <MolWeight> (239)
390.41032

>  <PCAT_CMPD_ID> (239)
WAY-301366

>  <CNC_ID> (239)
359371704

>  <transfer_container_id> (239)
PTN000000070

>  <COMPOUND_NUMBER> (239)
WAY-301366

>  <BAR_CODE_NO> (239)
3903779

>  <LOCATION_CODE> (239)
PTNCS

>  <AMOUNT_CURRENT> (239)
33.5

$$$$
WAY-301367
csChFnd80/10111816222D

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 17 19  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (240)
240

>  <Formula> (240)
C17H24N2O4S

>  <MolWeight> (240)
352.44846

>  <PCAT_CMPD_ID> (240)
WAY-301367

>  <CNC_ID> (240)
359371705

>  <transfer_container_id> (240)
PTN000000070

>  <COMPOUND_NUMBER> (240)
WAY-301367

>  <BAR_CODE_NO> (240)
3903780

>  <LOCATION_CODE> (240)
PTNCS

>  <AMOUNT_CURRENT> (240)
33.3

$$$$
WAY-301369
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (241)
241

>  <Formula> (241)
C20H20N2O4S2

>  <MolWeight> (241)
416.5138

>  <PCAT_CMPD_ID> (241)
WAY-301369

>  <CNC_ID> (241)
359371707

>  <transfer_container_id> (241)
PTN000000070

>  <COMPOUND_NUMBER> (241)
WAY-301369

>  <BAR_CODE_NO> (241)
3903782

>  <LOCATION_CODE> (241)
PTNCS

>  <AMOUNT_CURRENT> (241)
33.4

$$$$
WAY-301383
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (242)
242

>  <Formula> (242)
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>  <MolWeight> (242)
445.48882

>  <PCAT_CMPD_ID> (242)
WAY-301383

>  <CNC_ID> (242)
359371721

>  <transfer_container_id> (242)
PTN000000070

>  <COMPOUND_NUMBER> (242)
WAY-301383

>  <BAR_CODE_NO> (242)
3903800

>  <LOCATION_CODE> (242)
PTNCS

>  <AMOUNT_CURRENT> (242)
33.4

$$$$
WAY-301384
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (243)
243

>  <Formula> (243)
C23H22N4O3

>  <MolWeight> (243)
402.44578

>  <PCAT_CMPD_ID> (243)
WAY-301384

>  <CNC_ID> (243)
359371722

>  <transfer_container_id> (243)
PTN000000070

>  <COMPOUND_NUMBER> (243)
WAY-301384

>  <BAR_CODE_NO> (243)
3903801

>  <LOCATION_CODE> (243)
PTNCS

>  <AMOUNT_CURRENT> (243)
33.3

$$$$
WAY-301398
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (244)
244

>  <Formula> (244)
C16H13FO4

>  <MolWeight> (244)
288.2704232

>  <PCAT_CMPD_ID> (244)
WAY-301398

>  <CNC_ID> (244)
359371736

>  <transfer_container_id> (244)
PTN000000070

>  <COMPOUND_NUMBER> (244)
WAY-301398

>  <BAR_CODE_NO> (244)
3903824

>  <LOCATION_CODE> (244)
PTNCS

>  <AMOUNT_CURRENT> (244)
33.2

$$$$
WAY-301400
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 19 20  1  0  0  0  0
  7  8  1  0  0  0  0
 11 14  2  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (245)
245

>  <Formula> (245)
C14H7BrFNO3

>  <MolWeight> (245)
336.1126832

>  <PCAT_CMPD_ID> (245)
WAY-301400

>  <CNC_ID> (245)
359371738

>  <transfer_container_id> (245)
PTN000000070

>  <COMPOUND_NUMBER> (245)
WAY-301400

>  <BAR_CODE_NO> (245)
3903827

>  <LOCATION_CODE> (245)
PTNCS

>  <AMOUNT_CURRENT> (245)
33.4

$$$$
WAY-301412
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (246)
246

>  <Formula> (246)
C23H18N2O2S

>  <MolWeight> (246)
386.46622

>  <PCAT_CMPD_ID> (246)
WAY-301412

>  <CNC_ID> (246)
359371750

>  <transfer_container_id> (246)
PTN000000070

>  <COMPOUND_NUMBER> (246)
WAY-301412

>  <BAR_CODE_NO> (246)
3903839

>  <LOCATION_CODE> (246)
PTNCS

>  <AMOUNT_CURRENT> (246)
33.1

$$$$
WAY-301423
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (247)
247

>  <Formula> (247)
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>  <MolWeight> (247)
456.33956

>  <PCAT_CMPD_ID> (247)
WAY-301423

>  <CNC_ID> (247)
359371761

>  <transfer_container_id> (247)
PTN000000070

>  <COMPOUND_NUMBER> (247)
WAY-301423

>  <BAR_CODE_NO> (247)
3903851

>  <LOCATION_CODE> (247)
PTNCS

>  <AMOUNT_CURRENT> (247)
33.4

$$$$
WAY-301433
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (248)
248

>  <Formula> (248)
C14H14N2O2S

>  <MolWeight> (248)
274.33816

>  <PCAT_CMPD_ID> (248)
WAY-301433

>  <CNC_ID> (248)
359371771

>  <transfer_container_id> (248)
PTN000000070

>  <COMPOUND_NUMBER> (248)
WAY-301433

>  <BAR_CODE_NO> (248)
3903861

>  <LOCATION_CODE> (248)
PTNCS

>  <AMOUNT_CURRENT> (248)
33.1

$$$$
WAY-301436
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (249)
249

>  <Formula> (249)
C19H16ClF3N4OS

>  <MolWeight> (249)
440.8697496

>  <PCAT_CMPD_ID> (249)
WAY-301436

>  <CNC_ID> (249)
359371774

>  <transfer_container_id> (249)
PTN000000070

>  <COMPOUND_NUMBER> (249)
WAY-301436

>  <BAR_CODE_NO> (249)
3903864

>  <LOCATION_CODE> (249)
PTNCS

>  <AMOUNT_CURRENT> (249)
33.2

$$$$
WAY-301439
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 21 22  1  0  0  0  0
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M  END
>  <Mol_ID> (250)
250

>  <Formula> (250)
C21H18Cl2N4O4

>  <MolWeight> (250)
461.29802

>  <PCAT_CMPD_ID> (250)
WAY-301439

>  <CNC_ID> (250)
359371777

>  <transfer_container_id> (250)
PTN000000070

>  <COMPOUND_NUMBER> (250)
WAY-301439

>  <BAR_CODE_NO> (250)
3903868

>  <LOCATION_CODE> (250)
PTNCS

>  <AMOUNT_CURRENT> (250)
33.2

$$$$
WAY-301444
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (251)
251

>  <Formula> (251)
C14H7F6N3

>  <MolWeight> (251)
331.2158992

>  <PCAT_CMPD_ID> (251)
WAY-301444

>  <CNC_ID> (251)
359371782

>  <transfer_container_id> (251)
PTN000000070

>  <COMPOUND_NUMBER> (251)
WAY-301444

>  <BAR_CODE_NO> (251)
3903874

>  <LOCATION_CODE> (251)
PTNCS

>  <AMOUNT_CURRENT> (251)
33.4

$$$$
WAY-301449
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (252)
252

>  <Formula> (252)
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>  <MolWeight> (252)
363.40974

>  <PCAT_CMPD_ID> (252)
WAY-301449

>  <CNC_ID> (252)
359371787

>  <transfer_container_id> (252)
PTN000000070

>  <COMPOUND_NUMBER> (252)
WAY-301449

>  <BAR_CODE_NO> (252)
3903879

>  <LOCATION_CODE> (252)
PTNCS

>  <AMOUNT_CURRENT> (252)
33.4

$$$$
WAY-301461
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (253)
253

>  <Formula> (253)
C19H14ClN3O

>  <MolWeight> (253)
335.78696

>  <PCAT_CMPD_ID> (253)
WAY-301461

>  <CNC_ID> (253)
359371799

>  <transfer_container_id> (253)
PTN000000070

>  <COMPOUND_NUMBER> (253)
WAY-301461

>  <BAR_CODE_NO> (253)
3903894

>  <LOCATION_CODE> (253)
PTNCS

>  <AMOUNT_CURRENT> (253)
33.3

$$$$
WAY-301464
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (254)
254

>  <Formula> (254)
C18H13N3O

>  <MolWeight> (254)
287.31532

>  <PCAT_CMPD_ID> (254)
WAY-301464

>  <CNC_ID> (254)
359371802

>  <transfer_container_id> (254)
PTN000000070

>  <COMPOUND_NUMBER> (254)
WAY-301464

>  <BAR_CODE_NO> (254)
3903897

>  <LOCATION_CODE> (254)
PTNCS

>  <AMOUNT_CURRENT> (254)
33.3

$$$$
WAY-301471
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (255)
255

>  <Formula> (255)
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>  <MolWeight> (255)
433.52272

>  <PCAT_CMPD_ID> (255)
WAY-301471

>  <CNC_ID> (255)
359371809

>  <transfer_container_id> (255)
PTN000000070

>  <COMPOUND_NUMBER> (255)
WAY-301471

>  <BAR_CODE_NO> (255)
3903904

>  <LOCATION_CODE> (255)
PTNCS

>  <AMOUNT_CURRENT> (255)
33.2

$$$$
WAY-301472
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (256)
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>  <Formula> (256)
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>  <MolWeight> (256)
419.49614

>  <PCAT_CMPD_ID> (256)
WAY-301472

>  <CNC_ID> (256)
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>  <transfer_container_id> (256)
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>  <COMPOUND_NUMBER> (256)
WAY-301472

>  <BAR_CODE_NO> (256)
3903905

>  <LOCATION_CODE> (256)
PTNCS

>  <AMOUNT_CURRENT> (256)
33.2

$$$$
WAY-301476
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (257)
257

>  <Formula> (257)
C22H19N3O3S

>  <MolWeight> (257)
405.46956

>  <PCAT_CMPD_ID> (257)
WAY-301476

>  <CNC_ID> (257)
359371814

>  <transfer_container_id> (257)
PTN000000070

>  <COMPOUND_NUMBER> (257)
WAY-301476

>  <BAR_CODE_NO> (257)
3903909

>  <LOCATION_CODE> (257)
PTNCS

>  <AMOUNT_CURRENT> (257)
33.4

$$$$
WAY-301486
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (258)
258

>  <Formula> (258)
C23H18N2O4

>  <MolWeight> (258)
386.40002

>  <PCAT_CMPD_ID> (258)
WAY-301486

>  <CNC_ID> (258)
359371824

>  <transfer_container_id> (258)
PTN000000070

>  <COMPOUND_NUMBER> (258)
WAY-301486

>  <BAR_CODE_NO> (258)
3903921

>  <LOCATION_CODE> (258)
PTNCS

>  <AMOUNT_CURRENT> (258)
33

$$$$
WAY-301497
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 15  2  0  0  0  0
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 12 15  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (259)
259

>  <Formula> (259)
C12H8BrN3O2S

>  <MolWeight> (259)
338.17982

>  <PCAT_CMPD_ID> (259)
WAY-301497

>  <CNC_ID> (259)
359371835

>  <transfer_container_id> (259)
PTN000000070

>  <COMPOUND_NUMBER> (259)
WAY-301497

>  <BAR_CODE_NO> (259)
3903936

>  <LOCATION_CODE> (259)
PTNCS

>  <AMOUNT_CURRENT> (259)
33.2

$$$$
WAY-301501
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 12 14  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (260)
260

>  <Formula> (260)
C15H14N4S

>  <MolWeight> (260)
282.36346

>  <PCAT_CMPD_ID> (260)
WAY-301501

>  <CNC_ID> (260)
359371839

>  <transfer_container_id> (260)
PTN000000070

>  <COMPOUND_NUMBER> (260)
WAY-301501

>  <BAR_CODE_NO> (260)
3903943

>  <LOCATION_CODE> (260)
PTNCS

>  <AMOUNT_CURRENT> (260)
33.1

$$$$
WAY-301502
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 16 18  1  0  0  0  0
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M  END
>  <Mol_ID> (261)
261

>  <Formula> (261)
C21H18N2O2S2

>  <MolWeight> (261)
394.50982

>  <PCAT_CMPD_ID> (261)
WAY-301502

>  <CNC_ID> (261)
359371840

>  <transfer_container_id> (261)
PTN000000070

>  <COMPOUND_NUMBER> (261)
WAY-301502

>  <BAR_CODE_NO> (261)
3903945

>  <LOCATION_CODE> (261)
PTNCS

>  <AMOUNT_CURRENT> (261)
33.2

$$$$
WAY-301503
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (262)
262

>  <Formula> (262)
C14H9N3O4S

>  <MolWeight> (262)
315.30396

>  <PCAT_CMPD_ID> (262)
WAY-301503

>  <CNC_ID> (262)
359371841

>  <transfer_container_id> (262)
PTN000000070

>  <COMPOUND_NUMBER> (262)
WAY-301503

>  <BAR_CODE_NO> (262)
3903947

>  <LOCATION_CODE> (262)
PTNCS

>  <AMOUNT_CURRENT> (262)
33.1

$$$$
WAY-301509-A
csChFnd80/10111816222D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (263)
263

>  <Formula> (263)
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>  <MolWeight> (263)
168.2792

>  <PCAT_CMPD_ID> (263)
WAY-301509-A

>  <CNC_ID> (263)
359371847

>  <transfer_container_id> (263)
PTN000000070

>  <COMPOUND_NUMBER> (263)
WAY-301509-A

>  <BAR_CODE_NO> (263)
3903954

>  <LOCATION_CODE> (263)
PTNCS

>  <AMOUNT_CURRENT> (263)
33.2

$$$$
WAY-301523
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (264)
264

>  <Formula> (264)
C12H9N5O2

>  <MolWeight> (264)
255.23216

>  <PCAT_CMPD_ID> (264)
WAY-301523

>  <CNC_ID> (264)
359371861

>  <transfer_container_id> (264)
PTN000000070

>  <COMPOUND_NUMBER> (264)
WAY-301523

>  <BAR_CODE_NO> (264)
3903972

>  <LOCATION_CODE> (264)
PTNCS

>  <AMOUNT_CURRENT> (264)
33.1

$$$$
WAY-301524-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.1448   -1.0448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (265)
265

>  <Formula> (265)
C15H13N3O2S

>  <MolWeight> (265)
299.34762

>  <PCAT_CMPD_ID> (265)
WAY-301524-A

>  <CNC_ID> (265)
359371862

>  <transfer_container_id> (265)
PTN000000070

>  <COMPOUND_NUMBER> (265)
WAY-301524-A

>  <BAR_CODE_NO> (265)
3903973

>  <LOCATION_CODE> (265)
PTNCS

>  <AMOUNT_CURRENT> (265)
33.4

$$$$
WAY-301527
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (266)
266

>  <Formula> (266)
C16H15N3O2S

>  <MolWeight> (266)
313.3742

>  <PCAT_CMPD_ID> (266)
WAY-301527

>  <CNC_ID> (266)
359371865

>  <transfer_container_id> (266)
PTN000000070

>  <COMPOUND_NUMBER> (266)
WAY-301527

>  <BAR_CODE_NO> (266)
3903977

>  <LOCATION_CODE> (266)
PTNCS

>  <AMOUNT_CURRENT> (266)
33.4

$$$$
WAY-301528
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (267)
267

>  <Formula> (267)
C15H15N5O2

>  <MolWeight> (267)
297.3119

>  <PCAT_CMPD_ID> (267)
WAY-301528

>  <CNC_ID> (267)
359371866

>  <transfer_container_id> (267)
PTN000000070

>  <COMPOUND_NUMBER> (267)
WAY-301528

>  <BAR_CODE_NO> (267)
3903978

>  <LOCATION_CODE> (267)
PTNCS

>  <AMOUNT_CURRENT> (267)
33.1

$$$$
WAY-301535
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (268)
268

>  <Formula> (268)
C19H21ClN2O4S

>  <MolWeight> (268)
408.89904

>  <PCAT_CMPD_ID> (268)
WAY-301535

>  <CNC_ID> (268)
359371873

>  <transfer_container_id> (268)
PTN000000070

>  <COMPOUND_NUMBER> (268)
WAY-301535

>  <BAR_CODE_NO> (268)
3903987

>  <LOCATION_CODE> (268)
PTNCS

>  <AMOUNT_CURRENT> (268)
33

$$$$
WAY-301543
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (269)
269

>  <Formula> (269)
C15H16N4O2

>  <MolWeight> (269)
284.31314

>  <PCAT_CMPD_ID> (269)
WAY-301543

>  <CNC_ID> (269)
359371881

>  <transfer_container_id> (269)
PTN000000070

>  <COMPOUND_NUMBER> (269)
WAY-301543

>  <BAR_CODE_NO> (269)
3903995

>  <LOCATION_CODE> (269)
PTNCS

>  <AMOUNT_CURRENT> (269)
33.3

$$$$
WAY-301590
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 16 18  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (270)
270

>  <Formula> (270)
C15H16N2O3S

>  <MolWeight> (270)
304.36414

>  <PCAT_CMPD_ID> (270)
WAY-301590

>  <CNC_ID> (270)
359371928

>  <transfer_container_id> (270)
PTN000000070

>  <COMPOUND_NUMBER> (270)
WAY-301590

>  <BAR_CODE_NO> (270)
3904050

>  <LOCATION_CODE> (270)
PTNCS

>  <AMOUNT_CURRENT> (270)
33.3

$$$$
WAY-301595
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (271)
271

>  <Formula> (271)
C20H14N2O3

>  <MolWeight> (271)
330.33676

>  <PCAT_CMPD_ID> (271)
WAY-301595

>  <CNC_ID> (271)
359371933

>  <transfer_container_id> (271)
PTN000000070

>  <COMPOUND_NUMBER> (271)
WAY-301595

>  <BAR_CODE_NO> (271)
3904057

>  <LOCATION_CODE> (271)
PTNCS

>  <AMOUNT_CURRENT> (271)
33.5

$$$$
WAY-301607
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 13 19  1  0  0  0  0
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M  END
>  <Mol_ID> (272)
272

>  <Formula> (272)
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>  <MolWeight> (272)
270.2402

>  <PCAT_CMPD_ID> (272)
WAY-301607

>  <CNC_ID> (272)
359371945

>  <transfer_container_id> (272)
PTN000000070

>  <COMPOUND_NUMBER> (272)
WAY-301607

>  <BAR_CODE_NO> (272)
3904072

>  <LOCATION_CODE> (272)
PTNCS

>  <AMOUNT_CURRENT> (272)
33.4

$$$$
WAY-301613
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 23 26  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (273)
273

>  <Formula> (273)
C22H23N5O2

>  <MolWeight> (273)
389.45032

>  <PCAT_CMPD_ID> (273)
WAY-301613

>  <CNC_ID> (273)
359371951

>  <transfer_container_id> (273)
PTN000000070

>  <COMPOUND_NUMBER> (273)
WAY-301613

>  <BAR_CODE_NO> (273)
3904082

>  <LOCATION_CODE> (273)
PTNCS

>  <AMOUNT_CURRENT> (273)
33.2

$$$$
WAY-301614
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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  3  7  2  0  0  0  0
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  7  9  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (274)
274

>  <Formula> (274)
C15H23NO3

>  <MolWeight> (274)
265.34802

>  <PCAT_CMPD_ID> (274)
WAY-301614

>  <CNC_ID> (274)
359371952

>  <transfer_container_id> (274)
PTN000000070

>  <COMPOUND_NUMBER> (274)
WAY-301614

>  <BAR_CODE_NO> (274)
3904083

>  <LOCATION_CODE> (274)
PTNCS

>  <AMOUNT_CURRENT> (274)
33.1

$$$$
WAY-301627
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 10 12  1  0  0  0  0
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 18 20  2  0  0  0  0
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  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (275)
275

>  <Formula> (275)
C17H14N2O2S

>  <MolWeight> (275)
310.37026

>  <PCAT_CMPD_ID> (275)
WAY-301627

>  <CNC_ID> (275)
359371965

>  <transfer_container_id> (275)
PTN000000070

>  <COMPOUND_NUMBER> (275)
WAY-301627

>  <BAR_CODE_NO> (275)
3904101

>  <LOCATION_CODE> (275)
PTNCS

>  <AMOUNT_CURRENT> (275)
33.3

$$$$
WAY-301630
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 11 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (276)
276

>  <Formula> (276)
C20H14O4

>  <MolWeight> (276)
318.32276

>  <PCAT_CMPD_ID> (276)
WAY-301630

>  <CNC_ID> (276)
359371968

>  <transfer_container_id> (276)
PTN000000070

>  <COMPOUND_NUMBER> (276)
WAY-301630

>  <BAR_CODE_NO> (276)
3904105

>  <LOCATION_CODE> (276)
PTNCS

>  <AMOUNT_CURRENT> (276)
33.1

$$$$
WAY-301640
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 19 21  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (277)
277

>  <Formula> (277)
C21H21N5O

>  <MolWeight> (277)
359.42434

>  <PCAT_CMPD_ID> (277)
WAY-301640

>  <CNC_ID> (277)
359371978

>  <transfer_container_id> (277)
PTN000000070

>  <COMPOUND_NUMBER> (277)
WAY-301640

>  <BAR_CODE_NO> (277)
3904123

>  <LOCATION_CODE> (277)
PTNCS

>  <AMOUNT_CURRENT> (277)
33.3

$$$$
WAY-301641
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (278)
278

>  <Formula> (278)
C17H11Cl2NO2

>  <MolWeight> (278)
332.18074

>  <PCAT_CMPD_ID> (278)
WAY-301641

>  <CNC_ID> (278)
359371979

>  <transfer_container_id> (278)
PTN000000070

>  <COMPOUND_NUMBER> (278)
WAY-301641

>  <BAR_CODE_NO> (278)
3904125

>  <LOCATION_CODE> (278)
PTNCS

>  <AMOUNT_CURRENT> (278)
33.1

$$$$
WAY-382499
csChFnd80/10111816222D

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 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12 13  1  0  0  0  0
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 16  4  1  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
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 21 20  2  0  0  0  0
 12 14  2  0  0  0  0
M  END
>  <Mol_ID> (279)
279

>  <Formula> (279)
C18H18ClNO

>  <MolWeight> (279)
299.79462

>  <PCAT_CMPD_ID> (279)
WAY-382499

>  <CNC_ID> (279)
359372093

>  <transfer_container_id> (279)
PTN000000070

>  <COMPOUND_NUMBER> (279)
WAY-382499

>  <BAR_CODE_NO> (279)
2540813

>  <LOCATION_CODE> (279)
PTNCS

>  <AMOUNT_CURRENT> (279)
32.4

$$$$
WAY-382501
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
>  <Mol_ID> (280)
280

>  <Formula> (280)
C13H15Cl2NO

>  <MolWeight> (280)
272.1703

>  <PCAT_CMPD_ID> (280)
WAY-382501

>  <CNC_ID> (280)
359372095

>  <transfer_container_id> (280)
PTN000000070

>  <COMPOUND_NUMBER> (280)
WAY-382501

>  <BAR_CODE_NO> (280)
2540814

>  <LOCATION_CODE> (280)
PTNCS

>  <AMOUNT_CURRENT> (280)
32.1

$$$$
WAY-385119
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
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 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
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 15  2  1  0  0  0  0
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 17 16  1  0  0  0  0
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 22 20  2  0  0  0  0
 28 25  1  0  0  0  0
M  END
>  <Mol_ID> (281)
281

>  <Formula> (281)
C22H21N5O2

>  <MolWeight> (281)
387.43444

>  <PCAT_CMPD_ID> (281)
WAY-385119

>  <CNC_ID> (281)
359372120

>  <transfer_container_id> (281)
PTN000000070

>  <COMPOUND_NUMBER> (281)
WAY-385119

>  <BAR_CODE_NO> (281)
2540491

>  <LOCATION_CODE> (281)
PTNCS

>  <AMOUNT_CURRENT> (281)
32.7

$$$$
WAY-385123
csChFnd80/10111816222D

 37 42  0  0  0  0  0  0  0  0999 V2000
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 35 26  1  0  0  0  0
 36 32  1  0  0  0  0
 37 34  1  0  0  0  0
  8  7  1  0  0  0  0
  6  5  1  0  0  0  0
 33 37  2  0  0  0  0
 15 13  1  0  0  0  0
 25 30  1  0  0  0  0
 35 36  2  0  0  0  0
M  END
>  <Mol_ID> (282)
282

>  <Formula> (282)
C28H23N7O2

>  <MolWeight> (282)
489.52792

>  <PCAT_CMPD_ID> (282)
WAY-385123

>  <CNC_ID> (282)
359372123

>  <transfer_container_id> (282)
PTN000000070

>  <COMPOUND_NUMBER> (282)
WAY-385123

>  <BAR_CODE_NO> (282)
2540486

>  <LOCATION_CODE> (282)
PTNCS

>  <AMOUNT_CURRENT> (282)
32.2

$$$$
WAY-385531
csChFnd80/10111816222D

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 10  6  1  0  0  0  0
 11 10  1  0  0  0  0
 12 15  1  0  0  0  0
 13  2  1  0  0  0  0
 14  8  2  0  0  0  0
 15  9  1  0  0  0  0
 16  8  1  0  0  0  0
 17 25  1  0  0  0  0
 18 22  1  0  0  0  0
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 20 12  1  0  0  0  0
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 22 16  1  0  0  0  0
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 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
  3  5  1  0  0  0  0
  7 11  1  0  0  0  0
 26 17  1  0  0  0  0
 27 24  1  0  0  0  0
M  END
>  <Mol_ID> (283)
283

>  <Formula> (283)
C20H24N6O2

>  <MolWeight> (283)
380.44356

>  <PCAT_CMPD_ID> (283)
WAY-385531

>  <CNC_ID> (283)
359372157

>  <transfer_container_id> (283)
PTN000000070

>  <COMPOUND_NUMBER> (283)
WAY-385531

>  <BAR_CODE_NO> (283)
2540523

>  <LOCATION_CODE> (283)
PTNCS

>  <AMOUNT_CURRENT> (283)
32

$$$$
WAY-386346
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
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 10 12  1  0  0  0  0
 11  4  1  0  0  0  0
 12  8  1  0  0  0  0
 13  7  2  0  0  0  0
 14  8  2  0  0  0  0
 15 21  1  0  0  0  0
 16  7  1  0  0  0  0
 17  9  1  0  0  0  0
 18 11  1  0  0  0  0
 19 10  1  0  0  0  0
 20 10  1  0  0  0  0
 21 20  1  0  0  0  0
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 23 16  1  0  0  0  0
 24 18  1  0  0  0  0
  3  4  2  0  0  0  0
 17 18  1  0  0  0  0
 15 22  1  0  0  0  0
M  END
>  <Mol_ID> (284)
284

>  <Formula> (284)
C17H24N2O4S

>  <MolWeight> (284)
352.44846

>  <PCAT_CMPD_ID> (284)
WAY-386346

>  <CNC_ID> (284)
359372177

>  <transfer_container_id> (284)
PTN000000070

>  <COMPOUND_NUMBER> (284)
WAY-386346

>  <BAR_CODE_NO> (284)
2540576

>  <LOCATION_CODE> (284)
PTNCS

>  <AMOUNT_CURRENT> (284)
32.4

$$$$
WAY-386384
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 16  1  0  0  0  0
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 12  7  1  0  0  0  0
 13  8  2  0  0  0  0
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 16  6  1  0  0  0  0
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 18  9  2  0  0  0  0
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 22 21  1  0  0  0  0
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 22 20  2  0  0  0  0
 14 12  2  0  0  0  0
M  END
>  <Mol_ID> (285)
285

>  <Formula> (285)
C14H13N5OS2

>  <MolWeight> (285)
331.41592

>  <PCAT_CMPD_ID> (285)
WAY-386384

>  <CNC_ID> (285)
359372185

>  <transfer_container_id> (285)
PTN000000070

>  <COMPOUND_NUMBER> (285)
WAY-386384

>  <BAR_CODE_NO> (285)
2540611

>  <LOCATION_CODE> (285)
PTNCS

>  <AMOUNT_CURRENT> (285)
32

$$$$
WAY-386454
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 21 23  2  0  0  0  0
 31 32  2  0  0  0  0
M  END
>  <Mol_ID> (286)
286

>  <Formula> (286)
C25H23N3O2S2

>  <MolWeight> (286)
461.59902

>  <PCAT_CMPD_ID> (286)
WAY-386454

>  <CNC_ID> (286)
359372255

>  <transfer_container_id> (286)
PTN000000070

>  <COMPOUND_NUMBER> (286)
WAY-386454

>  <BAR_CODE_NO> (286)
2540687

>  <LOCATION_CODE> (286)
PTNCS

>  <AMOUNT_CURRENT> (286)
32.2

$$$$
WAY-386463
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (287)
287

>  <Formula> (287)
C17H19NO4S

>  <MolWeight> (287)
333.40206

>  <PCAT_CMPD_ID> (287)
WAY-386463

>  <CNC_ID> (287)
359372264

>  <transfer_container_id> (287)
PTN000000070

>  <COMPOUND_NUMBER> (287)
WAY-386463

>  <BAR_CODE_NO> (287)
2540727

>  <LOCATION_CODE> (287)
PTNCS

>  <AMOUNT_CURRENT> (287)
33

$$$$
WAY-386488
csChFnd80/10111816222D

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 10  9  1  0  0  0  0
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 10  5  2  0  0  0  0
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M  END
>  <Mol_ID> (288)
288

>  <Formula> (288)
C14H12N2S2

>  <MolWeight> (288)
272.38848

>  <PCAT_CMPD_ID> (288)
WAY-386488

>  <CNC_ID> (288)
359372289

>  <transfer_container_id> (288)
PTN000000070

>  <COMPOUND_NUMBER> (288)
WAY-386488

>  <BAR_CODE_NO> (288)
2540751

>  <LOCATION_CODE> (288)
PTNCS

>  <AMOUNT_CURRENT> (288)
32.4

$$$$
WAY-386489
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (289)
289

>  <Formula> (289)
C19H28N2O4S

>  <MolWeight> (289)
380.50162

>  <PCAT_CMPD_ID> (289)
WAY-386489

>  <CNC_ID> (289)
359372290

>  <transfer_container_id> (289)
PTN000000070

>  <COMPOUND_NUMBER> (289)
WAY-386489

>  <BAR_CODE_NO> (289)
2540749

>  <LOCATION_CODE> (289)
PTNCS

>  <AMOUNT_CURRENT> (289)
32.7

$$$$
WAY-386494
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (290)
290

>  <Formula> (290)
C21H16N2O2S2

>  <MolWeight> (290)
392.49394

>  <PCAT_CMPD_ID> (290)
WAY-386494

>  <CNC_ID> (290)
359372295

>  <transfer_container_id> (290)
PTN000000070

>  <COMPOUND_NUMBER> (290)
WAY-386494

>  <BAR_CODE_NO> (290)
2540743

>  <LOCATION_CODE> (290)
PTNCS

>  <AMOUNT_CURRENT> (290)
30.5

$$$$
WAY-386497
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (291)
291

>  <Formula> (291)
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>  <MolWeight> (291)
369.86784

>  <PCAT_CMPD_ID> (291)
WAY-386497

>  <CNC_ID> (291)
359372298

>  <transfer_container_id> (291)
PTN000000070

>  <COMPOUND_NUMBER> (291)
WAY-386497

>  <BAR_CODE_NO> (291)
2540754

>  <LOCATION_CODE> (291)
PTNCS

>  <AMOUNT_CURRENT> (291)
32.7

$$$$
WAY-386501
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (292)
292

>  <Formula> (292)
C23H18FN3O2S2

>  <MolWeight> (292)
451.5363232

>  <PCAT_CMPD_ID> (292)
WAY-386501

>  <CNC_ID> (292)
359372301

>  <transfer_container_id> (292)
PTN000000070

>  <COMPOUND_NUMBER> (292)
WAY-386501

>  <BAR_CODE_NO> (292)
2540757

>  <LOCATION_CODE> (292)
PTNCS

>  <AMOUNT_CURRENT> (292)
32.5

$$$$
WAY-386516
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (293)
293

>  <Formula> (293)
C15H15N3

>  <MolWeight> (293)
237.2997

>  <PCAT_CMPD_ID> (293)
WAY-386516

>  <CNC_ID> (293)
359372316

>  <transfer_container_id> (293)
PTN000000070

>  <COMPOUND_NUMBER> (293)
WAY-386516

>  <BAR_CODE_NO> (293)
2540785

>  <LOCATION_CODE> (293)
PTNCS

>  <AMOUNT_CURRENT> (293)
32.1

$$$$
WAY-386518
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 20 21  1  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <Mol_ID> (294)
294

>  <Formula> (294)
C16H14N2O2S

>  <MolWeight> (294)
298.35956

>  <PCAT_CMPD_ID> (294)
WAY-386518

>  <CNC_ID> (294)
359372318

>  <transfer_container_id> (294)
PTN000000070

>  <COMPOUND_NUMBER> (294)
WAY-386518

>  <BAR_CODE_NO> (294)
2540783

>  <LOCATION_CODE> (294)
PTNCS

>  <AMOUNT_CURRENT> (294)
32.3

$$$$
WAY-386745
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (295)
295

>  <Formula> (295)
C24H21N3O4

>  <MolWeight> (295)
415.44124

>  <PCAT_CMPD_ID> (295)
WAY-386745

>  <CNC_ID> (295)
359372343

>  <transfer_container_id> (295)
PTN000000070

>  <COMPOUND_NUMBER> (295)
WAY-386745

>  <BAR_CODE_NO> (295)
2540553

>  <LOCATION_CODE> (295)
PTNCS

>  <AMOUNT_CURRENT> (295)
32.7

$$$$
WAY-386756
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
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M  END
>  <Mol_ID> (296)
296

>  <Formula> (296)
C22H21N5O2

>  <MolWeight> (296)
387.43444

>  <PCAT_CMPD_ID> (296)
WAY-386756

>  <CNC_ID> (296)
359372351

>  <transfer_container_id> (296)
PTN000000070

>  <COMPOUND_NUMBER> (296)
WAY-386756

>  <BAR_CODE_NO> (296)
2540549

>  <LOCATION_CODE> (296)
PTNCS

>  <AMOUNT_CURRENT> (296)
33

$$$$
WAY-388258
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  1  0  0  0  0
  9  4  2  0  0  0  0
 10 16  1  0  0  0  0
 11  3  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  1  0  0  0  0
 14  8  1  0  0  0  0
 15  8  1  0  0  0  0
 16 15  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
 19  7  2  0  0  0  0
 20 10  1  0  0  0  0
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 22 21  2  0  0  0  0
 23 18  1  0  0  0  0
  2  4  1  0  0  0  0
 17 10  1  0  0  0  0
 18 22  1  0  0  0  0
M  END
>  <Mol_ID> (297)
297

>  <Formula> (297)
C16H20N4OS2

>  <MolWeight> (297)
348.4862

>  <PCAT_CMPD_ID> (297)
WAY-388258

>  <CNC_ID> (297)
359372402

>  <transfer_container_id> (297)
PTN000000070

>  <COMPOUND_NUMBER> (297)
WAY-388258

>  <BAR_CODE_NO> (297)
2540641

>  <LOCATION_CODE> (297)
PTNCS

>  <AMOUNT_CURRENT> (297)
32.4

$$$$
WAY-388278
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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   10.9167   -6.1417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  6  2  0  0  0  0
 10 12  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  7  1  0  0  0  0
 14 17  1  0  0  0  0
 15  8  1  0  0  0  0
 16  8  2  0  0  0  0
 17 13  2  0  0  0  0
 18 15  2  0  0  0  0
 19 16  1  0  0  0  0
 20 19  2  0  0  0  0
  2  4  1  0  0  0  0
 14 10  2  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (298)
298

>  <Formula> (298)
C15H12N4O

>  <MolWeight> (298)
264.28198

>  <PCAT_CMPD_ID> (298)
WAY-388278

>  <CNC_ID> (298)
359372422

>  <transfer_container_id> (298)
PTN000000070

>  <COMPOUND_NUMBER> (298)
WAY-388278

>  <BAR_CODE_NO> (298)
2540816

>  <LOCATION_CODE> (298)
PTNCS

>  <AMOUNT_CURRENT> (298)
32.4

$$$$
WAY-388294
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   12.1250   -6.3250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10 16  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14 13  2  0  0  0  0
 15  7  1  0  0  0  0
 16 15  2  0  0  0  0
 17  9  1  0  0  0  0
 18  9  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 21 17  2  0  0  0  0
 22 19  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 15  1  0  0  0  0
 21 19  1  0  0  0  0
 10 23  2  0  0  0  0
  4  2  1  0  0  0  0
 14  8  1  0  0  0  0
M  END
>  <Mol_ID> (299)
299

>  <Formula> (299)
C17H12FN3O2S2

>  <MolWeight> (299)
373.4244832

>  <PCAT_CMPD_ID> (299)
WAY-388294

>  <CNC_ID> (299)
359372437

>  <transfer_container_id> (299)
PTN000000070

>  <COMPOUND_NUMBER> (299)
WAY-388294

>  <BAR_CODE_NO> (299)
2540853

>  <LOCATION_CODE> (299)
PTNCS

>  <AMOUNT_CURRENT> (299)
32.5

$$$$
WAY-388301
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  5  1  0  0  0  0
 12  5  1  0  0  0  0
 13 11  1  0  0  0  0
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 15  4  2  0  0  0  0
 16  2  1  0  0  0  0
 17  1  1  0  0  0  0
 18 10  1  0  0  0  0
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 20  7  1  0  0  0  0
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 24 18  2  0  0  0  0
M  END
>  <Mol_ID> (300)
300

>  <Formula> (300)
C19H22ClN3O3S

>  <MolWeight> (300)
407.91428

>  <PCAT_CMPD_ID> (300)
WAY-388301

>  <CNC_ID> (300)
359372443

>  <transfer_container_id> (300)
PTN000000070

>  <COMPOUND_NUMBER> (300)
WAY-388301

>  <BAR_CODE_NO> (300)
2540822

>  <LOCATION_CODE> (300)
PTNCS

>  <AMOUNT_CURRENT> (300)
32.4

$$$$
WAY-388308
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 25 22  2  0  0  0  0
 26 24  2  0  0  0  0
  6  4  1  0  0  0  0
 10  7  1  0  0  0  0
 26 25  1  0  0  0  0
 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (301)
301

>  <Formula> (301)
C20H15N3OS2

>  <MolWeight> (301)
377.4826

>  <PCAT_CMPD_ID> (301)
WAY-388308

>  <CNC_ID> (301)
359372449

>  <transfer_container_id> (301)
PTN000000070

>  <COMPOUND_NUMBER> (301)
WAY-388308

>  <BAR_CODE_NO> (301)
2540855

>  <LOCATION_CODE> (301)
PTNCS

>  <AMOUNT_CURRENT> (301)
32.8

$$$$
WAY-388333
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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   10.2375   -8.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2042   -6.2667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1875   -6.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.4250   -4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.2000   -6.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 14  1  0  0  0  0
  8  7  1  0  0  0  0
  9  2  2  0  0  0  0
 10  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
 13  6  2  0  0  0  0
 14  5  1  0  0  0  0
 15 16  1  0  0  0  0
 16  6  1  0  0  0  0
 17 15  1  0  0  0  0
 18  1  2  0  0  0  0
 19  3  2  0  0  0  0
 20 17  2  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 22  2  0  0  0  0
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 25 20  1  0  0  0  0
 26 24  1  0  0  0  0
 23 19  1  0  0  0  0
 12 11  2  0  0  0  0
 26 25  2  0  0  0  0
M  END
>  <Mol_ID> (302)
302

>  <Formula> (302)
C20H18N2O4

>  <MolWeight> (302)
350.36792

>  <PCAT_CMPD_ID> (302)
WAY-388333

>  <CNC_ID> (302)
359372473

>  <transfer_container_id> (302)
PTN000000070

>  <COMPOUND_NUMBER> (302)
WAY-388333

>  <BAR_CODE_NO> (302)
2540879

>  <LOCATION_CODE> (302)
PTNCS

>  <AMOUNT_CURRENT> (302)
32.8

$$$$
WAY-388345
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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   11.9167   -3.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7792   -3.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9375   -2.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0042   -7.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  4  1  0  0  0  0
  7 10  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11 21  2  0  0  0  0
 12  7  2  0  0  0  0
 13  1  1  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 17  1  0  0  0  0
 17 15  2  0  0  0  0
 18 14  1  0  0  0  0
 19 16  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22  8  1  0  0  0  0
 23  8  2  0  0  0  0
 24 13  1  0  0  0  0
 25 24  1  0  0  0  0
  5  3  1  0  0  0  0
 11 20  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <Mol_ID> (303)
303

>  <Formula> (303)
C18H17ClN4OS

>  <MolWeight> (303)
372.87178

>  <PCAT_CMPD_ID> (303)
WAY-388345

>  <CNC_ID> (303)
359372485

>  <transfer_container_id> (303)
PTN000000070

>  <COMPOUND_NUMBER> (303)
WAY-388345

>  <BAR_CODE_NO> (303)
2540890

>  <LOCATION_CODE> (303)
PTNCS

>  <AMOUNT_CURRENT> (303)
32.6

$$$$
WAY-388362
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.3792   -5.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  2  0  0  0  0
 10  4  1  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 16  1  0  0  0  0
 16 11  2  0  0  0  0
 17 10  2  0  0  0  0
 18 10  1  0  0  0  0
 19 15  2  0  0  0  0
 20 17  1  0  0  0  0
 21 18  2  0  0  0  0
 22 21  1  0  0  0  0
  3  4  2  0  0  0  0
 20 22  2  0  0  0  0
 19 13  1  0  0  0  0
M  END
>  <Mol_ID> (304)
304

>  <Formula> (304)
C15H11ClN4O2

>  <MolWeight> (304)
314.72644

>  <PCAT_CMPD_ID> (304)
WAY-388362

>  <CNC_ID> (304)
359372502

>  <transfer_container_id> (304)
PTN000000070

>  <COMPOUND_NUMBER> (304)
WAY-388362

>  <BAR_CODE_NO> (304)
2540909

>  <LOCATION_CODE> (304)
PTNCS

>  <AMOUNT_CURRENT> (304)
32.2

$$$$
WAY-388364
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.3417   -0.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4375   -1.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8417   -1.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  2  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  7  2  0  0  0  0
 12  9  2  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15 17  2  0  0  0  0
 16 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
 19 15  1  0  0  0  0
 20  9  1  0  0  0  0
 21 12  1  0  0  0  0
 22 20  2  0  0  0  0
 23 22  1  0  0  0  0
  4  3  2  0  0  0  0
 18 15  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (305)
305

>  <Formula> (305)
C15H10Cl2N4O2

>  <MolWeight> (305)
349.1715

>  <PCAT_CMPD_ID> (305)
WAY-388364

>  <CNC_ID> (305)
359372504

>  <transfer_container_id> (305)
PTN000000070

>  <COMPOUND_NUMBER> (305)
WAY-388364

>  <BAR_CODE_NO> (305)
2540911

>  <LOCATION_CODE> (305)
PTNCS

>  <AMOUNT_CURRENT> (305)
32.4

$$$$
WAY-388376
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   11.2792   -6.2792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23 20  1  0  0  0  0
 24 19  1  0  0  0  0
  4  5  1  0  0  0  0
 15 16  2  0  0  0  0
 21 20  2  0  0  0  0
M  END
>  <Mol_ID> (306)
306

>  <Formula> (306)
C17H16FN3O3

>  <MolWeight> (306)
329.3256432

>  <PCAT_CMPD_ID> (306)
WAY-388376

>  <CNC_ID> (306)
359372515

>  <transfer_container_id> (306)
PTN000000070

>  <COMPOUND_NUMBER> (306)
WAY-388376

>  <BAR_CODE_NO> (306)
2540921

>  <LOCATION_CODE> (306)
PTNCS

>  <AMOUNT_CURRENT> (306)
32.5

$$$$
WAY-388392
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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   11.0750   -7.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0792   -7.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8250  -12.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6 12  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  1  1  0  0  0  0
 10  7  1  0  0  0  0
 11  8  2  0  0  0  0
 12 14  1  0  0  0  0
 13 11  1  0  0  0  0
 14  9  1  0  0  0  0
 15 12  2  0  0  0  0
 16  2  1  0  0  0  0
 17  8  1  0  0  0  0
 18 10  1  0  0  0  0
 19 13  1  0  0  0  0
  5  4  2  0  0  0  0
 10 13  2  0  0  0  0
M  END
>  <Mol_ID> (307)
307

>  <Formula> (307)
C13H16N4OS

>  <MolWeight> (307)
276.35734

>  <PCAT_CMPD_ID> (307)
WAY-388392

>  <CNC_ID> (307)
359372531

>  <transfer_container_id> (307)
PTN000000070

>  <COMPOUND_NUMBER> (307)
WAY-388392

>  <BAR_CODE_NO> (307)
2540947

>  <LOCATION_CODE> (307)
PTNCS

>  <AMOUNT_CURRENT> (307)
33

$$$$
WAY-388398
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    9.6542   -4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8167   -6.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6417   -5.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  2  0  0  0  0
 11  8  2  0  0  0  0
 12 15  2  0  0  0  0
 13 14  1  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 12  1  0  0  0  0
 17  2  1  0  0  0  0
 18  5  1  0  0  0  0
 19  8  1  0  0  0  0
 20 13  1  0  0  0  0
 21 12  1  0  0  0  0
  3  5  2  0  0  0  0
 13 16  2  0  0  0  0
M  END
>  <Mol_ID> (308)
308

>  <Formula> (308)
C17H20N2O2

>  <MolWeight> (308)
284.3529

>  <PCAT_CMPD_ID> (308)
WAY-388398

>  <CNC_ID> (308)
359372538

>  <transfer_container_id> (308)
PTN000000070

>  <COMPOUND_NUMBER> (308)
WAY-388398

>  <BAR_CODE_NO> (308)
2540952

>  <LOCATION_CODE> (308)
PTNCS

>  <AMOUNT_CURRENT> (308)
33

$$$$
WAY-388401
csChFnd80/10111816222D

 28 29  0  0  0  0  0  0  0  0999 V2000
    6.4167   -4.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3542   -3.3292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  5  1  2  0  0  0  0
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  7  5  1  0  0  0  0
  8 10  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
 12 14  1  0  0  0  0
 13  4  2  0  0  0  0
 14 20  1  0  0  0  0
 15  9  2  0  0  0  0
 16  6  1  0  0  0  0
 17 11  2  0  0  0  0
 18 11  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  2  0  0  0  0
 21 10  1  0  0  0  0
 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
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 25 16  1  0  0  0  0
 26 21  1  0  0  0  0
 27 21  1  0  0  0  0
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  6  7  2  0  0  0  0
 14 19  2  0  0  0  0
M  END
>  <Mol_ID> (309)
309

>  <Formula> (309)
C20H28N4O2S2

>  <MolWeight> (309)
420.59192

>  <PCAT_CMPD_ID> (309)
WAY-388401

>  <CNC_ID> (309)
359372541

>  <transfer_container_id> (309)
PTN000000070

>  <COMPOUND_NUMBER> (309)
WAY-388401

>  <BAR_CODE_NO> (309)
2540949

>  <LOCATION_CODE> (309)
PTNCS

>  <AMOUNT_CURRENT> (309)
29

$$$$
WAY-388431
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  7  1  0  0  0  0
 12  2  2  0  0  0  0
 13  9  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  1  0  0  0  0
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 19  3  1  0  0  0  0
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 22  5  1  0  0  0  0
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  3  4  1  0  0  0  0
 28 29  2  0  0  0  0
 10 11  2  0  0  0  0
 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (310)
310

>  <Formula> (310)
C20H18ClN5O2S

>  <MolWeight> (310)
427.90722

>  <PCAT_CMPD_ID> (310)
WAY-388431

>  <CNC_ID> (310)
359372571

>  <transfer_container_id> (310)
PTN000000070

>  <COMPOUND_NUMBER> (310)
WAY-388431

>  <BAR_CODE_NO> (310)
2540976

>  <LOCATION_CODE> (310)
PTNCS

>  <AMOUNT_CURRENT> (310)
32.1

$$$$
WAY-388451
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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    5.7167   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  8  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7  3  2  0  0  0  0
  8 10  1  0  0  0  0
  9 12  1  0  0  0  0
 10  7  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  2  0  0  0  0
 13  4  2  0  0  0  0
 14 15  1  0  0  0  0
 15  4  1  0  0  0  0
 16 17  2  0  0  0  0
 17 14  1  0  0  0  0
 18  9  1  0  0  0  0
 19 11  1  0  0  0  0
 20  2  1  0  0  0  0
 21  2  1  0  0  0  0
 22  3  1  0  0  0  0
 23 22  2  0  0  0  0
 24 23  1  0  0  0  0
 25 18  1  0  0  0  0
 26 19  1  0  0  0  0
 27 20  1  0  0  0  0
 28 21  1  0  0  0  0
 29 28  1  0  0  0  0
 30 27  1  0  0  0  0
 24 10  2  0  0  0  0
 30 29  1  0  0  0  0
 11  9  2  0  0  0  0
M  END
>  <Mol_ID> (311)
311

>  <Formula> (311)
C22H28N2O5S

>  <MolWeight> (311)
432.53312

>  <PCAT_CMPD_ID> (311)
WAY-388451

>  <CNC_ID> (311)
359372589

>  <transfer_container_id> (311)
PTN000000070

>  <COMPOUND_NUMBER> (311)
WAY-388451

>  <BAR_CODE_NO> (311)
2541005

>  <LOCATION_CODE> (311)
PTNCS

>  <AMOUNT_CURRENT> (311)
32.6

$$$$
WAY-388456
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   11.2292   -5.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9875   -2.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.6667   -9.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  9  1  0  0  0  0
  4  2  1  0  0  0  0
  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  1  1  0  0  0  0
  9 16  2  0  0  0  0
 10  3  2  0  0  0  0
 11  3  2  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16 20  1  0  0  0  0
 17 19  2  0  0  0  0
 18  4  1  0  0  0  0
 19 21  1  0  0  0  0
 20 21  2  0  0  0  0
 21 25  1  0  0  0  0
 22  6  2  0  0  0  0
 23  7  2  0  0  0  0
 24 15  1  0  0  0  0
 25 24  1  0  0  0  0
 26 18  1  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
  5  4  1  0  0  0  0
 23 28  1  0  0  0  0
 17  9  1  0  0  0  0
M  END
>  <Mol_ID> (312)
312

>  <Formula> (312)
C19H20N4O4S

>  <MolWeight> (312)
400.4515

>  <PCAT_CMPD_ID> (312)
WAY-388456

>  <CNC_ID> (312)
359372594

>  <transfer_container_id> (312)
PTN000000070

>  <COMPOUND_NUMBER> (312)
WAY-388456

>  <BAR_CODE_NO> (312)
2541000

>  <LOCATION_CODE> (312)
PTNCS

>  <AMOUNT_CURRENT> (312)
32.8

$$$$
WAY-388514
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    8.5875   -4.3292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0792   -6.0625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.6000   -5.0667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.6792   -6.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.7042   -5.0292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3000   -5.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1667   -7.9792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3875   -7.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.4042   -5.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4875   -7.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 12  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  4  2  0  0  0  0
  9  5  2  0  0  0  0
 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14  3  1  0  0  0  0
 15  7  2  0  0  0  0
 16  1  1  0  0  0  0
 17 16  1  0  0  0  0
 18 14  2  0  0  0  0
 19 14  1  0  0  0  0
 20 17  2  0  0  0  0
 21 23  1  0  0  0  0
 22 10  2  0  0  0  0
 23 19  2  0  0  0  0
 24 18  1  0  0  0  0
 25 21  1  0  0  0  0
 26 13  2  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
  6  8  1  0  0  0  0
 24 21  2  0  0  0  0
 13  9  1  0  0  0  0
 26 28  1  0  0  0  0
M  END
>  <Mol_ID> (313)
313

>  <Formula> (313)
C19H15ClN6OS

>  <MolWeight> (313)
410.88

>  <PCAT_CMPD_ID> (313)
WAY-388514

>  <CNC_ID> (313)
359372652

>  <transfer_container_id> (313)
PTN000000070

>  <COMPOUND_NUMBER> (313)
WAY-388514

>  <BAR_CODE_NO> (313)
2541063

>  <LOCATION_CODE> (313)
PTNCS

>  <AMOUNT_CURRENT> (313)
32.7

$$$$
WAY-388518
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   12.5542  -12.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7417  -12.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.8000  -13.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7292  -11.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  2  1  0  0  0  0
  6  7  1  0  0  0  0
  7 10  2  0  0  0  0
  8  5  1  0  0  0  0
  9 15  1  0  0  0  0
 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
 12  4  1  0  0  0  0
 13  6  1  0  0  0  0
 14  9  1  0  0  0  0
 15 16  2  0  0  0  0
 16 10  1  0  0  0  0
 17  4  1  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 12  8  2  0  0  0  0
  9  6  2  0  0  0  0
 19 18  1  0  0  0  0
M  END
>  <Mol_ID> (314)
314

>  <Formula> (314)
C14H13NO3S

>  <MolWeight> (314)
275.32292

>  <PCAT_CMPD_ID> (314)
WAY-388518

>  <CNC_ID> (314)
359372656

>  <transfer_container_id> (314)
PTN000000070

>  <COMPOUND_NUMBER> (314)
WAY-388518

>  <BAR_CODE_NO> (314)
2541069

>  <LOCATION_CODE> (314)
PTNCS

>  <AMOUNT_CURRENT> (314)
32.9

$$$$
WAY-388584
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    4.4167   -1.0250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
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  6  5  2  0  0  0  0
  7 11  1  0  0  0  0
  8  6  1  0  0  0  0
  9  5  1  0  0  0  0
 10  1  1  0  0  0  0
 11 14  1  0  0  0  0
 12  3  2  0  0  0  0
 13  2  1  0  0  0  0
 14  9  2  0  0  0  0
 15  7  2  0  0  0  0
 16 17  1  0  0  0  0
 17 10  1  0  0  0  0
 18  7  1  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
 21 17  1  0  0  0  0
 22 21  1  0  0  0  0
  6  4  1  0  0  0  0
 22 19  1  0  0  0  0
  8 11  2  0  0  0  0
M  END
>  <Mol_ID> (315)
315

>  <Formula> (315)
C15H16N2O4S

>  <MolWeight> (315)
320.36354

>  <PCAT_CMPD_ID> (315)
WAY-388584

>  <CNC_ID> (315)
359372722

>  <transfer_container_id> (315)
PTN000000070

>  <COMPOUND_NUMBER> (315)
WAY-388584

>  <BAR_CODE_NO> (315)
2541148

>  <LOCATION_CODE> (315)
PTNCS

>  <AMOUNT_CURRENT> (315)
32.4

$$$$
WAY-388585
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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   12.5125   -7.0625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8042   -8.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8542  -10.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  8  3  1  0  0  0  0
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 10 15  1  0  0  0  0
 11  9  2  0  0  0  0
 12  8  1  0  0  0  0
 13  5  1  0  0  0  0
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 15 13  1  0  0  0  0
 16 10  2  0  0  0  0
 17  1  1  0  0  0  0
 18  8  2  0  0  0  0
 19  9  1  0  0  0  0
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 22 14  2  0  0  0  0
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 28 23  2  0  0  0  0
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  6  4  1  0  0  0  0
 29 30  2  0  0  0  0
 12  7  1  0  0  0  0
 26 21  2  0  0  0  0
 20 27  1  0  0  0  0
M  END
>  <Mol_ID> (316)
316

>  <Formula> (316)
C23H18N4OS2

>  <MolWeight> (316)
430.54522

>  <PCAT_CMPD_ID> (316)
WAY-388585

>  <CNC_ID> (316)
359372723

>  <transfer_container_id> (316)
PTN000000070

>  <COMPOUND_NUMBER> (316)
WAY-388585

>  <BAR_CODE_NO> (316)
2541137

>  <LOCATION_CODE> (316)
PTNCS

>  <AMOUNT_CURRENT> (316)
32

$$$$
WAY-388686
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   10.8000   -9.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3042  -11.0917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    5.2875  -12.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  1  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  9  1  0  0  0  0
 11  4  2  0  0  0  0
 12  8  1  0  0  0  0
 13  7  1  0  0  0  0
 14 12  2  0  0  0  0
 15 12  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18 16  1  0  0  0  0
  8 10  2  0  0  0  0
  6  7  1  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (317)
317

>  <Formula> (317)
C14H14N2OS

>  <MolWeight> (317)
258.33876

>  <PCAT_CMPD_ID> (317)
WAY-388686

>  <CNC_ID> (317)
359372824

>  <transfer_container_id> (317)
PTN000000070

>  <COMPOUND_NUMBER> (317)
WAY-388686

>  <BAR_CODE_NO> (317)
2541247

>  <LOCATION_CODE> (317)
PTNCS

>  <AMOUNT_CURRENT> (317)
33

$$$$
WAY-388713
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.2875   -7.0625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5375  -12.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5 14  1  0  0  0  0
  6  3  2  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
  9  1  2  0  0  0  0
 10  1  2  0  0  0  0
 11  4  1  0  0  0  0
 12  4  1  0  0  0  0
 13  7  1  0  0  0  0
 14 12  1  0  0  0  0
 15 11  1  0  0  0  0
 16  2  2  0  0  0  0
 17  6  1  0  0  0  0
 18  8  2  0  0  0  0
 19  8  1  0  0  0  0
 20 21  1  0  0  0  0
 21 19  2  0  0  0  0
 22 18  1  0  0  0  0
 23 20  1  0  0  0  0
 24  6  1  0  0  0  0
 25 23  1  0  0  0  0
 26 25  1  0  0  0  0
 20 22  2  0  0  0  0
 15  5  1  0  0  0  0
 17 13  2  0  0  0  0
M  END
>  <Mol_ID> (318)
318

>  <Formula> (318)
C18H22N2O4S2

>  <MolWeight> (318)
394.50828

>  <PCAT_CMPD_ID> (318)
WAY-388713

>  <CNC_ID> (318)
359372851

>  <transfer_container_id> (318)
PTN000000070

>  <COMPOUND_NUMBER> (318)
WAY-388713

>  <BAR_CODE_NO> (318)
2541266

>  <LOCATION_CODE> (318)
PTNCS

>  <AMOUNT_CURRENT> (318)
32.3

$$$$
WAY-388720
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   12.0292  -10.2250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  4  8  1  0  0  0  0
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  9  7  1  0  0  0  0
 10  4  2  0  0  0  0
 11  2  1  0  0  0  0
 12 13  1  0  0  0  0
 13 11  2  0  0  0  0
 14 19  1  0  0  0  0
 15 20  2  0  0  0  0
 16  3  1  0  0  0  0
 17  4  1  0  0  0  0
 18 16  1  0  0  0  0
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 20 18  1  0  0  0  0
 21  9  1  0  0  0  0
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 23 21  2  0  0  0  0
 24 22  2  0  0  0  0
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  8 14  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (319)
319

>  <Formula> (319)
C18H15NO4S

>  <MolWeight> (319)
341.381

>  <PCAT_CMPD_ID> (319)
WAY-388720

>  <CNC_ID> (319)
359372858

>  <transfer_container_id> (319)
PTN000000070

>  <COMPOUND_NUMBER> (319)
WAY-388720

>  <BAR_CODE_NO> (319)
2541281

>  <LOCATION_CODE> (319)
PTNCS

>  <AMOUNT_CURRENT> (319)
32.1

$$$$
WAY-388756
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
    5.1042   -3.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  6  1  0  0  0  0
 11  9  1  0  0  0  0
 12  9  2  0  0  0  0
 13 11  1  0  0  0  0
 14  4  1  0  0  0  0
 15 12  1  0  0  0  0
 16 10  1  0  0  0  0
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 10  5  2  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (320)
320

>  <Formula> (320)
C11H7ClN2S2

>  <MolWeight> (320)
266.76968

>  <PCAT_CMPD_ID> (320)
WAY-388756

>  <CNC_ID> (320)
359372894

>  <transfer_container_id> (320)
PTN000000070

>  <COMPOUND_NUMBER> (320)
WAY-388756

>  <BAR_CODE_NO> (320)
2541352

>  <LOCATION_CODE> (320)
PTNCS

>  <AMOUNT_CURRENT> (320)
32.6

$$$$
WAY-388799
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
    2.2125    0.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14  5  1  0  0  0  0
 15 11  2  0  0  0  0
 16 10  1  0  0  0  0
 17 13  1  0  0  0  0
 18 12  1  0  0  0  0
  5  3  1  0  0  0  0
 18 14  1  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (321)
321

>  <Formula> (321)
C14H12ClNOS

>  <MolWeight> (321)
277.76918

>  <PCAT_CMPD_ID> (321)
WAY-388799

>  <CNC_ID> (321)
359372937

>  <transfer_container_id> (321)
PTN000000070

>  <COMPOUND_NUMBER> (321)
WAY-388799

>  <BAR_CODE_NO> (321)
2541388

>  <LOCATION_CODE> (321)
PTNCS

>  <AMOUNT_CURRENT> (321)
32.3

$$$$
WAY-388800
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    2.2125    0.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12 10  2  0  0  0  0
 13  5  1  0  0  0  0
 14  7  2  0  0  0  0
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 12  1  0  0  0  0
 18 11  1  0  0  0  0
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  5  3  1  0  0  0  0
 19 13  1  0  0  0  0
 16 12  1  0  0  0  0
M  END
>  <Mol_ID> (322)
322

>  <Formula> (322)
C16H17NOS

>  <MolWeight> (322)
271.37728

>  <PCAT_CMPD_ID> (322)
WAY-388800

>  <CNC_ID> (322)
359372938

>  <transfer_container_id> (322)
PTN000000070

>  <COMPOUND_NUMBER> (322)
WAY-388800

>  <BAR_CODE_NO> (322)
2541389

>  <LOCATION_CODE> (322)
PTNCS

>  <AMOUNT_CURRENT> (322)
32.7

$$$$
WAY-388802
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   13.5500   -6.9292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0917   -3.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6542   -5.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3917   -6.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7542  -12.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  4  1  0  0  0  0
  9 11  1  0  0  0  0
 10  1  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  2  0  0  0  0
 14 10  1  0  0  0  0
 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  2  0  0  0  0
 20 19  1  0  0  0  0
 14 13  1  0  0  0  0
 20 18  2  0  0  0  0
  6  8  2  0  0  0  0
M  END
>  <Mol_ID> (323)
323

>  <Formula> (323)
C14H15N3OS2

>  <MolWeight> (323)
305.4184

>  <PCAT_CMPD_ID> (323)
WAY-388802

>  <CNC_ID> (323)
359372940

>  <transfer_container_id> (323)
PTN000000070

>  <COMPOUND_NUMBER> (323)
WAY-388802

>  <BAR_CODE_NO> (323)
2541353

>  <LOCATION_CODE> (323)
PTNCS

>  <AMOUNT_CURRENT> (323)
32.4

$$$$
WAY-388854
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   14.3042  -10.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8542   -7.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4625   -8.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5500   -7.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5375   -8.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -11.1542    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.9917   -9.1667    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
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 10  1  1  0  0  0  0
 11  4  1  0  0  0  0
 12 14  1  0  0  0  0
 13 12  1  0  0  0  0
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 15  3  1  0  0  0  0
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 17 15  2  0  0  0  0
 18 13  1  0  0  0  0
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 21 19  1  0  0  0  0
 22 18  2  0  0  0  0
 23 21  2  0  0  0  0
 16  5  2  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (324)
324

>  <Formula> (324)
C18H18F3NO

>  <MolWeight> (324)
321.3368296

>  <PCAT_CMPD_ID> (324)
WAY-388854

>  <CNC_ID> (324)
359372991

>  <transfer_container_id> (324)
PTN000000070

>  <COMPOUND_NUMBER> (324)
WAY-388854

>  <BAR_CODE_NO> (324)
2541409

>  <LOCATION_CODE> (324)
PTNCS

>  <AMOUNT_CURRENT> (324)
32.4

$$$$
WAY-388878
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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   -1.4958   -6.3417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
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  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11  6  1  0  0  0  0
 12  5  2  0  0  0  0
 13 10  1  0  0  0  0
 14  2  1  0  0  0  0
 15 18  1  0  0  0  0
 16  9  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  2  0  0  0  0
 19 11  1  0  0  0  0
  8  4  2  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (325)
325

>  <Formula> (325)
C11H12ClN5OS

>  <MolWeight> (325)
297.76388

>  <PCAT_CMPD_ID> (325)
WAY-388878

>  <CNC_ID> (325)
359373015

>  <transfer_container_id> (325)
PTN000000070

>  <COMPOUND_NUMBER> (325)
WAY-388878

>  <BAR_CODE_NO> (325)
2541441

>  <LOCATION_CODE> (325)
PTNCS

>  <AMOUNT_CURRENT> (325)
32.7

$$$$
WAY-388909
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12 13  2  0  0  0  0
 13 18  1  0  0  0  0
 14  9  1  0  0  0  0
 15  5  1  0  0  0  0
 16  6  1  0  0  0  0
 17 12  1  0  0  0  0
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 20 13  1  0  0  0  0
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 22 17  1  0  0  0  0
 23 15  2  0  0  0  0
 24 23  1  0  0  0  0
  3  4  1  0  0  0  0
 16 24  2  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (326)
326

>  <Formula> (326)
C18H16N2O4

>  <MolWeight> (326)
324.33064

>  <PCAT_CMPD_ID> (326)
WAY-388909

>  <CNC_ID> (326)
359373046

>  <transfer_container_id> (326)
PTN000000070

>  <COMPOUND_NUMBER> (326)
WAY-388909

>  <BAR_CODE_NO> (326)
2541471

>  <LOCATION_CODE> (326)
PTNCS

>  <AMOUNT_CURRENT> (326)
32.5

$$$$
WAY-388928
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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   13.9667   -9.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9917  -11.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4875  -10.3417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5000  -10.3292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5042   -8.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4917   -8.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0042   -7.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0042   -9.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5042   -6.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9917   -9.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5042   -6.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 14  2  0  0  0  0
  4  1  2  0  0  0  0
  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7 13  1  0  0  0  0
  8 11  2  0  0  0  0
  9  7  2  0  0  0  0
 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 12  6  1  0  0  0  0
 13 17  1  0  0  0  0
 14  5  1  0  0  0  0
 15  1  1  0  0  0  0
 16 21  2  0  0  0  0
 17 20  1  0  0  0  0
 18  5  2  0  0  0  0
 19 12  1  0  0  0  0
 20 15  1  0  0  0  0
 21 18  1  0  0  0  0
 16  3  1  0  0  0  0
  6 10  2  0  0  0  0
M  END
>  <Mol_ID> (327)
327

>  <Formula> (327)
C16H18N2O3

>  <MolWeight> (327)
286.32572

>  <PCAT_CMPD_ID> (327)
WAY-388928

>  <CNC_ID> (327)
359373065

>  <transfer_container_id> (327)
PTN000000070

>  <COMPOUND_NUMBER> (327)
WAY-388928

>  <BAR_CODE_NO> (327)
2541492

>  <LOCATION_CODE> (327)
PTNCS

>  <AMOUNT_CURRENT> (327)
32.7

$$$$
WAY-389023
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    8.6375   -5.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4125   -5.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2417   -6.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6125   -7.3500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.9125   -8.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3042   -7.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3792   -7.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1417   -8.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0542   -3.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.4750   -6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0750   -7.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9292   -6.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7667   -7.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2875   -9.5125    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.1542   -6.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.4000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  6  2  1  0  0  0  0
  7  8  2  0  0  0  0
  8 14  1  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11 12  2  0  0  0  0
 12  1  1  0  0  0  0
 13  3  1  0  0  0  0
 14 13  1  0  0  0  0
 15  8  1  0  0  0  0
 16 18  1  0  0  0  0
 17  7  1  0  0  0  0
 18 15  2  0  0  0  0
 19 16  1  0  0  0  0
  6 11  1  0  0  0  0
  9  4  2  0  0  0  0
 10 16  2  0  0  0  0
M  END
>  <Mol_ID> (328)
328

>  <Formula> (328)
C13H8ClFN2OS

>  <MolWeight> (328)
294.7318232

>  <PCAT_CMPD_ID> (328)
WAY-389023

>  <CNC_ID> (328)
359373158

>  <transfer_container_id> (328)
PTN000000070

>  <COMPOUND_NUMBER> (328)
WAY-389023

>  <BAR_CODE_NO> (328)
2541586

>  <LOCATION_CODE> (328)
PTNCS

>  <AMOUNT_CURRENT> (328)
33

$$$$
WAY-389038
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   10.1792   -5.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4250   -4.4667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1167   -6.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4792   -5.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1875   -4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4125   -6.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4292   -6.5625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.2000   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1667   -4.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0417   -7.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4542   -7.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9750   -4.5750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3917   -8.9167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.0625   -5.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9500   -3.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3417   -2.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3375   -7.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0167  -10.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3250   -2.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  5  1  0  0  0  0
 10  6  1  0  0  0  0
 11  3  2  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14  6  2  0  0  0  0
 15 12  2  0  0  0  0
 16  9  2  0  0  0  0
 17 10  2  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 22 19  2  0  0  0  0
  8  5  2  0  0  0  0
 17 22  1  0  0  0  0
 20 15  1  0  0  0  0
M  END
>  <Mol_ID> (329)
329

>  <Formula> (329)
C16H13N3OS2

>  <MolWeight> (329)
327.42392

>  <PCAT_CMPD_ID> (329)
WAY-389038

>  <CNC_ID> (329)
359373173

>  <transfer_container_id> (329)
PTN000000070

>  <COMPOUND_NUMBER> (329)
WAY-389038

>  <BAR_CODE_NO> (329)
2541601

>  <LOCATION_CODE> (329)
PTNCS

>  <AMOUNT_CURRENT> (329)
32.3

$$$$
WAY-389063
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
   -0.6300    0.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0600    0.2537    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8160   -0.5053    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5040    0.4337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1160    0.4217    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4190   -0.5053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6020    0.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6330    1.0217    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9480    0.0377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1690    0.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5420    0.1637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8970   -0.5563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8420   -0.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  4  2  0  0  0  0
  9  4  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12  9  1  0  0  0  0
 13 12  1  0  0  0  0
 14 11  1  0  0  0  0
  7  6  2  0  0  0  0
 14 13  1  0  0  0  0
M  END
>  <Mol_ID> (330)
330

>  <Formula> (330)
C10H14N2OS

>  <MolWeight> (330)
210.29596

>  <PCAT_CMPD_ID> (330)
WAY-389063

>  <CNC_ID> (330)
359373197

>  <transfer_container_id> (330)
PTN000000070

>  <COMPOUND_NUMBER> (330)
WAY-389063

>  <BAR_CODE_NO> (330)
2541632

>  <LOCATION_CODE> (330)
PTNCS

>  <AMOUNT_CURRENT> (330)
29.3

$$$$
WAY-389072
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   14.8125  -12.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9792  -10.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3250   -9.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0167   -9.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2125  -11.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1667  -10.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3625   -8.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8667  -11.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3917  -11.3042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1500  -13.5625    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -13.1042    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.9875  -11.7125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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   14.2000   -9.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3250   -4.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  8  1  0  0  0  0
  7  4  2  0  0  0  0
  8  5  2  0  0  0  0
  9  2  2  0  0  0  0
 10  7  1  0  0  0  0
 11  1  1  0  0  0  0
 12  1  1  0  0  0  0
 13  1  1  0  0  0  0
 14  5  1  0  0  0  0
 15  4  1  0  0  0  0
 16 17  1  0  0  0  0
 17 14  2  0  0  0  0
 18  7  1  0  0  0  0
 19 10  2  0  0  0  0
 20 10  1  0  0  0  0
 21 15  2  0  0  0  0
 22 21  1  0  0  0  0
 23 19  1  0  0  0  0
 24 20  2  0  0  0  0
 25 24  1  0  0  0  0
  6 16  2  0  0  0  0
 18 22  2  0  0  0  0
 23 25  2  0  0  0  0
M  END
>  <Mol_ID> (331)
331

>  <Formula> (331)
C20H14F3NO

>  <MolWeight> (331)
341.3264696

>  <PCAT_CMPD_ID> (331)
WAY-389072

>  <CNC_ID> (331)
359373206

>  <transfer_container_id> (331)
PTN000000070

>  <COMPOUND_NUMBER> (331)
WAY-389072

>  <BAR_CODE_NO> (331)
2541641

>  <LOCATION_CODE> (331)
PTNCS

>  <AMOUNT_CURRENT> (331)
32.6

$$$$
WAY-389073
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    9.2667   -8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.3750   -9.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  6  2  0  0  0  0
 11  5  2  0  0  0  0
 12 13  2  0  0  0  0
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 14  6  1  0  0  0  0
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 17  2  2  0  0  0  0
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 24 19  2  0  0  0  0
 25 24  1  0  0  0  0
 26 23  2  0  0  0  0
 27 25  2  0  0  0  0
  8  3  1  0  0  0  0
 27 26  1  0  0  0  0
 10 12  1  0  0  0  0
 15 18  1  0  0  0  0
M  END
>  <Mol_ID> (332)
332

>  <Formula> (332)
C20H16N2O5

>  <MolWeight> (332)
364.35144

>  <PCAT_CMPD_ID> (332)
WAY-389073

>  <CNC_ID> (332)
359373207

>  <transfer_container_id> (332)
PTN000000070

>  <COMPOUND_NUMBER> (332)
WAY-389073

>  <BAR_CODE_NO> (332)
2541642

>  <LOCATION_CODE> (332)
PTNCS

>  <AMOUNT_CURRENT> (332)
32.4

$$$$
WAY-389079
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
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  5 10  1  0  0  0  0
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  7  8  2  0  0  0  0
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  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
 12  5  2  0  0  0  0
 13 11  2  0  0  0  0
 14  2  2  0  0  0  0
 15 13  1  0  0  0  0
 16  6  2  0  0  0  0
 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 19  9  2  0  0  0  0
 20 15  1  0  0  0  0
 21 14  1  0  0  0  0
 22 21  2  0  0  0  0
  9  7  1  0  0  0  0
 22 19  1  0  0  0  0
 18 13  1  0  0  0  0
M  END
>  <Mol_ID> (333)
333

>  <Formula> (333)
C17H14N2O2S

>  <MolWeight> (333)
310.37026

>  <PCAT_CMPD_ID> (333)
WAY-389079

>  <CNC_ID> (333)
359373213

>  <transfer_container_id> (333)
PTN000000070

>  <COMPOUND_NUMBER> (333)
WAY-389079

>  <BAR_CODE_NO> (333)
2541762

>  <LOCATION_CODE> (333)
PTNCS

>  <AMOUNT_CURRENT> (333)
29.5

$$$$
WAY-389103-A
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   11.9042   -9.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5000  -10.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6 17  1  0  0  0  0
  7  4  2  0  0  0  0
  8  4  1  0  0  0  0
  9  1  2  0  0  0  0
 10 18  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  1  0  0  0  0
 13 10  2  0  0  0  0
 14  8  2  0  0  0  0
 15  7  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18  6  1  0  0  0  0
 19 14  1  0  0  0  0
 20 13  1  0  0  0  0
 21 15  1  0  0  0  0
 22  8  1  0  0  0  0
 23  5  1  0  0  0  0
 24 20  1  0  0  0  0
 25 20  2  0  0  0  0
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 27 24  2  0  0  0  0
 28 25  1  0  0  0  0
 29 28  2  0  0  0  0
 16  6  1  0  0  0  0
 15 19  2  0  0  0  0
 27 29  1  0  0  0  0
M  END
>  <Mol_ID> (334)
334

>  <Formula> (334)
C23H28ClN3O2

>  <MolWeight> (334)
413.94032

>  <PCAT_CMPD_ID> (334)
WAY-389103-A

>  <CNC_ID> (334)
359373236

>  <transfer_container_id> (334)
PTN000000070

>  <COMPOUND_NUMBER> (334)
WAY-389103-A

>  <BAR_CODE_NO> (334)
2541670

>  <LOCATION_CODE> (334)
PTNCS

>  <AMOUNT_CURRENT> (334)
32.8

$$$$
WAY-389147
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  8  9  1  0  0  0  0
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 10 18  1  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13  9  2  0  0  0  0
 14  6  1  0  0  0  0
 15 12  2  0  0  0  0
 16 12  1  0  0  0  0
 17  3  1  0  0  0  0
 18 17  1  0  0  0  0
 19 21  1  0  0  0  0
 20 15  1  0  0  0  0
 21 16  2  0  0  0  0
 22 19  1  0  0  0  0
 23  4  2  0  0  0  0
 24  5  2  0  0  0  0
 25 11  1  0  0  0  0
 26 23  1  0  0  0  0
 27 24  1  0  0  0  0
  5  4  1  0  0  0  0
 27 26  2  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (335)
335

>  <Formula> (335)
C20H19FN4OS

>  <MolWeight> (335)
382.4544632

>  <PCAT_CMPD_ID> (335)
WAY-389147

>  <CNC_ID> (335)
359373276

>  <transfer_container_id> (335)
PTN000000070

>  <COMPOUND_NUMBER> (335)
WAY-389147

>  <BAR_CODE_NO> (335)
2541712

>  <LOCATION_CODE> (335)
PTNCS

>  <AMOUNT_CURRENT> (335)
32.9

$$$$
WAY-389166
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  1  1  0  0  0  0
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 10  4  2  0  0  0  0
 11  8  1  0  0  0  0
 12  7  1  0  0  0  0
 13  9  2  0  0  0  0
 14 13  1  0  0  0  0
 15  8  1  0  0  0  0
 16  2  2  0  0  0  0
 17 13  1  0  0  0  0
 18 16  1  0  0  0  0
 19  7  2  0  0  0  0
 20 18  2  0  0  0  0
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 22 15  1  0  0  0  0
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 25 24  2  0  0  0  0
 12 20  1  0  0  0  0
 21 25  1  0  0  0  0
 14 11  2  0  0  0  0
M  END
>  <Mol_ID> (336)
336

>  <Formula> (336)
C21H19NO3

>  <MolWeight> (336)
333.38046

>  <PCAT_CMPD_ID> (336)
WAY-389166

>  <CNC_ID> (336)
359373294

>  <transfer_container_id> (336)
PTN000000070

>  <COMPOUND_NUMBER> (336)
WAY-389166

>  <BAR_CODE_NO> (336)
2541732

>  <LOCATION_CODE> (336)
PTNCS

>  <AMOUNT_CURRENT> (336)
32.7

$$$$
WAY-389175
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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   13.6375   -2.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8 16  1  0  0  0  0
  9  6  1  0  0  0  0
 10 12  2  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13 11  1  0  0  0  0
 14 20  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17  7  2  0  0  0  0
 18  7  1  0  0  0  0
 19 14  1  0  0  0  0
 20 12  1  0  0  0  0
  5  2  1  0  0  0  0
 15  8  2  0  0  0  0
 11 19  2  0  0  0  0
M  END
>  <Mol_ID> (337)
337

>  <Formula> (337)
C14H10BrN3OS

>  <MolWeight> (337)
348.2177

>  <PCAT_CMPD_ID> (337)
WAY-389175

>  <CNC_ID> (337)
359373303

>  <transfer_container_id> (337)
PTN000000070

>  <COMPOUND_NUMBER> (337)
WAY-389175

>  <BAR_CODE_NO> (337)
2541760

>  <LOCATION_CODE> (337)
PTNCS

>  <AMOUNT_CURRENT> (337)
32.7

$$$$
WAY-389228
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   12.9542   -7.4167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9542   -2.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9625   -5.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500   -0.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9792   -9.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9917  -10.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500   -3.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9542   -7.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9500   -3.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9417   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9875  -10.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9417   -3.9667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9542    1.2583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9667   -9.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9417   -0.4667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9542   -2.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0042  -12.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9417   -5.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -12.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9542   -3.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0167  -14.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0125  -14.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9542   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  7  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  9  1  0  0  0  0
  8  1  1  0  0  0  0
  9 10  1  0  0  0  0
 10  3  1  0  0  0  0
 11 14  1  0  0  0  0
 12  3  2  0  0  0  0
 13  4  2  0  0  0  0
 14  8  1  0  0  0  0
 15  4  1  0  0  0  0
 16  2  2  0  0  0  0
 17  6  1  0  0  0  0
 18  7  2  0  0  0  0
 19 11  1  0  0  0  0
 20 23  2  0  0  0  0
 21 17  2  0  0  0  0
 22 19  2  0  0  0  0
 23 18  1  0  0  0  0
 11  6  2  0  0  0  0
 22 21  1  0  0  0  0
 16 20  1  0  0  0  0
M  END
>  <Mol_ID> (338)
338

>  <Formula> (338)
C18H18N2O3

>  <MolWeight> (338)
310.34712

>  <PCAT_CMPD_ID> (338)
WAY-389228

>  <CNC_ID> (338)
359373353

>  <transfer_container_id> (338)
PTN000000070

>  <COMPOUND_NUMBER> (338)
WAY-389228

>  <BAR_CODE_NO> (338)
2541792

>  <LOCATION_CODE> (338)
PTNCS

>  <AMOUNT_CURRENT> (338)
32.6

$$$$
WAY-389248
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   12.3042   -8.8667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.6750   -7.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2792   -6.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5292   -8.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5042   -6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1375   -7.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4417   -7.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2542   -9.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6917   -9.9375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8167   -6.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5875   -6.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6500   -5.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1125   -5.6375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4167   -5.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9625   -7.8042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9792   -5.6750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.3667   -7.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1542   -9.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7417   -5.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3875   -9.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1250   -4.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  7  2  0  0  0  0
 11 10  1  0  0  0  0
 12  3  1  0  0  0  0
 13  5  2  0  0  0  0
 14 10  1  0  0  0  0
 15 11  2  0  0  0  0
 16 11  1  0  0  0  0
 17  6  2  0  0  0  0
 18  4  2  0  0  0  0
 19 16  1  0  0  0  0
 20 21  2  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
  5  3  1  0  0  0  0
 20 17  1  0  0  0  0
 14 12  2  0  0  0  0
M  END
>  <Mol_ID> (339)
339

>  <Formula> (339)
C16H13NO4S

>  <MolWeight> (339)
315.34372

>  <PCAT_CMPD_ID> (339)
WAY-389248

>  <CNC_ID> (339)
359373373

>  <transfer_container_id> (339)
PTN000000070

>  <COMPOUND_NUMBER> (339)
WAY-389248

>  <BAR_CODE_NO> (339)
2541833

>  <LOCATION_CODE> (339)
PTNCS

>  <AMOUNT_CURRENT> (339)
32.9

$$$$
WAY-389260
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
    9.2167   -5.0542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0417   -3.0875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7917   -6.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6792   -7.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5375   -7.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8292   -1.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2625   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9542   -6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0167  -10.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4292   -9.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7750   -4.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.2375   -6.0125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7042   -8.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4042   -7.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2917   -9.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9875   -8.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0375  -11.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6042  -11.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4792    0.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 13  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  8  1  0  0  0  0
  6  2  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  1  0  0  0  0
  9 10  1  0  0  0  0
 10 20  2  0  0  0  0
 11  1  1  0  0  0  0
 12  1  1  0  0  0  0
 13 12  1  0  0  0  0
 14 11  1  0  0  0  0
 15  3  2  0  0  0  0
 16  4  2  0  0  0  0
 17  7  1  0  0  0  0
 18  7  2  0  0  0  0
 19 17  2  0  0  0  0
 20 18  1  0  0  0  0
 21  6  1  0  0  0  0
 22  6  2  0  0  0  0
 23 24  2  0  0  0  0
 24 22  1  0  0  0  0
 25 21  2  0  0  0  0
 26 23  1  0  0  0  0
 27  9  1  0  0  0  0
 28  9  1  0  0  0  0
 29  9  1  0  0  0  0
 30 26  1  0  0  0  0
 14  2  1  0  0  0  0
 25 23  1  0  0  0  0
 10 19  1  0  0  0  0
M  END
>  <Mol_ID> (340)
340

>  <Formula> (340)
C24H31N3O3

>  <MolWeight> (340)
409.52124

>  <PCAT_CMPD_ID> (340)
WAY-389260

>  <CNC_ID> (340)
359373385

>  <transfer_container_id> (340)
PTN000000070

>  <COMPOUND_NUMBER> (340)
WAY-389260

>  <BAR_CODE_NO> (340)
2541820

>  <LOCATION_CODE> (340)
PTNCS

>  <AMOUNT_CURRENT> (340)
33

$$$$
WAY-233609
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
   12.9255   -0.4700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0440   -0.4700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2815   -0.4700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3955   -1.2340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5935    0.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5790   -1.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7125    0.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6975   -1.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2765   -1.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3955    0.2595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6880   -0.4750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0440    1.0230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2815    1.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2815   -1.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5690   -0.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -1.2385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5690   -2.0025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  8  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  6  2  0  0  0  0
  9  4  1  0  0  0  0
 10  1  2  0  0  0  0
 11  9  2  0  0  0  0
 12  6  1  0  0  0  0
 13  5  2  0  0  0  0
 14  7  2  0  0  0  0
 15  8  1  0  0  0  0
 16 11  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  2  0  0  0  0
 19 13  1  0  0  0  0
 20 19  2  0  0  0  0
 21 18  1  0  0  0  0
 22 23  1  0  0  0  0
 23 17  2  0  0  0  0
  3  7  1  0  0  0  0
 22 16  2  0  0  0  0
 21 15  2  0  0  0  0
 14 20  1  0  0  0  0
M  END
>  <Mol_ID> (341)
341

>  <Formula> (341)
C19H14N2O2

>  <MolWeight> (341)
302.32666

>  <PCAT_CMPD_ID> (341)
WAY-233609

>  <CNC_ID> (341)
359394411

>  <transfer_container_id> (341)
PTN000000072

>  <COMPOUND_NUMBER> (341)
WAY-233609

>  <BAR_CODE_NO> (341)
3907842

>  <LOCATION_CODE> (341)
PTNCS

>  <AMOUNT_CURRENT> (341)
33.5

$$$$
WAY-233764
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    3.8796   -1.3136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1969   -2.4619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9796   -0.3032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2210   -1.3274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8900   -2.1826    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8762   -2.4964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (342)
342

>  <Formula> (342)
C16H14BrN3O

>  <MolWeight> (342)
344.20586

>  <PCAT_CMPD_ID> (342)
WAY-233764

>  <CNC_ID> (342)
359394413

>  <transfer_container_id> (342)
PTN000000072

>  <COMPOUND_NUMBER> (342)
WAY-233764

>  <BAR_CODE_NO> (342)
3908611

>  <LOCATION_CODE> (342)
PTNCS

>  <AMOUNT_CURRENT> (342)
33.6

$$$$
WAY-236601
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 10  4  2  0  0  0  0
 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
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 14  9  1  0  0  0  0
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 17 10  1  0  0  0  0
 18 16  2  0  0  0  0
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 20  3  1  0  0  0  0
 21  5  1  0  0  0  0
 22  7  1  0  0  0  0
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 25 26  1  0  0  0  0
 15 14  1  0  0  0  0
M  END
>  <Mol_ID> (343)
343

>  <Formula> (343)
C18H18N6O2S

>  <MolWeight> (343)
382.43952

>  <PCAT_CMPD_ID> (343)
WAY-236601

>  <CNC_ID> (343)
359394442

>  <transfer_container_id> (343)
PTN000000072

>  <COMPOUND_NUMBER> (343)
WAY-236601

>  <BAR_CODE_NO> (343)
3908186

>  <LOCATION_CODE> (343)
PTNCS

>  <AMOUNT_CURRENT> (343)
33.7

$$$$
WAY-238287
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 17 20  1  0  0  0  0
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  9 12  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (344)
344

>  <Formula> (344)
C16H17NO2S

>  <MolWeight> (344)
287.37668

>  <PCAT_CMPD_ID> (344)
WAY-238287

>  <CNC_ID> (344)
359394459

>  <transfer_container_id> (344)
PTN000000072

>  <COMPOUND_NUMBER> (344)
WAY-238287

>  <BAR_CODE_NO> (344)
3906756

>  <LOCATION_CODE> (344)
PTNCS

>  <AMOUNT_CURRENT> (344)
33.7

$$$$
WAY-238418
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  5  7  1  0  0  0  0
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 17 20  1  0  0  0  0
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M  END
>  <Mol_ID> (345)
345

>  <Formula> (345)
C20H17N5O2

>  <MolWeight> (345)
359.38128

>  <PCAT_CMPD_ID> (345)
WAY-238418

>  <CNC_ID> (345)
359394460

>  <transfer_container_id> (345)
PTN000000072

>  <COMPOUND_NUMBER> (345)
WAY-238418

>  <BAR_CODE_NO> (345)
3906425

>  <LOCATION_CODE> (345)
PTNCS

>  <AMOUNT_CURRENT> (345)
33.9

$$$$
WAY-239360
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (346)
346

>  <Formula> (346)
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>  <MolWeight> (346)
430.49564

>  <PCAT_CMPD_ID> (346)
WAY-239360

>  <CNC_ID> (346)
359394470

>  <transfer_container_id> (346)
PTN000000072

>  <COMPOUND_NUMBER> (346)
WAY-239360

>  <BAR_CODE_NO> (346)
3906470

>  <LOCATION_CODE> (346)
PTNCS

>  <AMOUNT_CURRENT> (346)
33.2

$$$$
WAY-239499
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (347)
347

>  <Formula> (347)
C15H14Cl2N2O2

>  <MolWeight> (347)
325.18986

>  <PCAT_CMPD_ID> (347)
WAY-239499

>  <CNC_ID> (347)
359394472

>  <transfer_container_id> (347)
PTN000000072

>  <COMPOUND_NUMBER> (347)
WAY-239499

>  <BAR_CODE_NO> (347)
3907356

>  <LOCATION_CODE> (347)
PTNCS

>  <AMOUNT_CURRENT> (347)
33.8

$$$$
WAY-240079
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  8  1  0  0  0  0
 12  5  1  0  0  0  0
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 14  4  2  0  0  0  0
 15  6  2  0  0  0  0
 16  3  1  0  0  0  0
 17 25  1  0  0  0  0
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 20 12  1  0  0  0  0
 21 23  1  0  0  0  0
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 13 11  2  0  0  0  0
 22 21  2  0  0  0  0
 27 17  2  0  0  0  0
M  END
>  <Mol_ID> (348)
348

>  <Formula> (348)
C22H17FN2O4

>  <MolWeight> (348)
392.3797832

>  <PCAT_CMPD_ID> (348)
WAY-240079

>  <CNC_ID> (348)
359394486

>  <transfer_container_id> (348)
PTN000000072

>  <COMPOUND_NUMBER> (348)
WAY-240079

>  <BAR_CODE_NO> (348)
3907233

>  <LOCATION_CODE> (348)
PTNCS

>  <AMOUNT_CURRENT> (348)
33.7

$$$$
WAY-241560
csChFnd80/10111816222D

 18 18  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
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 15  2  1  0  0  0  0
 16 12  1  0  0  0  0
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  3  4  1  0  0  0  0
M  END
>  <Mol_ID> (349)
349

>  <Formula> (349)
C12H19NO5

>  <MolWeight> (349)
257.28296

>  <PCAT_CMPD_ID> (349)
WAY-241560

>  <CNC_ID> (349)
359394499

>  <transfer_container_id> (349)
PTN000000072

>  <COMPOUND_NUMBER> (349)
WAY-241560

>  <BAR_CODE_NO> (349)
3907763

>  <LOCATION_CODE> (349)
PTNCS

>  <AMOUNT_CURRENT> (349)
33.7

$$$$
WAY-241597
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (350)
350

>  <Formula> (350)
C13H15N3O3

>  <MolWeight> (350)
261.2765

>  <PCAT_CMPD_ID> (350)
WAY-241597

>  <CNC_ID> (350)
359394500

>  <transfer_container_id> (350)
PTN000000072

>  <COMPOUND_NUMBER> (350)
WAY-241597

>  <BAR_CODE_NO> (350)
3907207

>  <LOCATION_CODE> (350)
PTNCS

>  <AMOUNT_CURRENT> (350)
33.5

$$$$
WAY-249107
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (351)
351

>  <Formula> (351)
C14H10N2O2S

>  <MolWeight> (351)
270.3064

>  <PCAT_CMPD_ID> (351)
WAY-249107

>  <CNC_ID> (351)
359394519

>  <transfer_container_id> (351)
PTN000000072

>  <COMPOUND_NUMBER> (351)
WAY-249107

>  <BAR_CODE_NO> (351)
3906295

>  <LOCATION_CODE> (351)
PTNCS

>  <AMOUNT_CURRENT> (351)
33.5

$$$$
WAY-249566
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (352)
352

>  <Formula> (352)
C16H11ClN2OS

>  <MolWeight> (352)
314.78934

>  <PCAT_CMPD_ID> (352)
WAY-249566

>  <CNC_ID> (352)
359394520

>  <transfer_container_id> (352)
PTN000000072

>  <COMPOUND_NUMBER> (352)
WAY-249566

>  <BAR_CODE_NO> (352)
3907587

>  <LOCATION_CODE> (352)
PTNCS

>  <AMOUNT_CURRENT> (352)
33

$$$$
WAY-251181
csChFnd80/10111816222D

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  7 11  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (353)
353

>  <Formula> (353)
C15H17NO4S

>  <MolWeight> (353)
307.36478

>  <PCAT_CMPD_ID> (353)
WAY-251181

>  <CNC_ID> (353)
359394524

>  <transfer_container_id> (353)
PTN000000072

>  <COMPOUND_NUMBER> (353)
WAY-251181

>  <BAR_CODE_NO> (353)
3906851

>  <LOCATION_CODE> (353)
PTNCS

>  <AMOUNT_CURRENT> (353)
33.5

$$$$
WAY-303349
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (354)
354

>  <Formula> (354)
C18H17N3O4

>  <MolWeight> (354)
339.34528

>  <PCAT_CMPD_ID> (354)
WAY-303349

>  <CNC_ID> (354)
359394529

>  <transfer_container_id> (354)
PTN000000072

>  <COMPOUND_NUMBER> (354)
WAY-303349

>  <BAR_CODE_NO> (354)
3906205

>  <LOCATION_CODE> (354)
PTNCS

>  <AMOUNT_CURRENT> (354)
33.4

$$$$
WAY-303375
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (355)
355

>  <Formula> (355)
C22H21N5O

>  <MolWeight> (355)
371.43504

>  <PCAT_CMPD_ID> (355)
WAY-303375

>  <CNC_ID> (355)
359394555

>  <transfer_container_id> (355)
PTN000000072

>  <COMPOUND_NUMBER> (355)
WAY-303375

>  <BAR_CODE_NO> (355)
3906234

>  <LOCATION_CODE> (355)
PTNCS

>  <AMOUNT_CURRENT> (355)
33.6

$$$$
WAY-303376
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 20 21  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (356)
356

>  <Formula> (356)
C23H23N5O2

>  <MolWeight> (356)
401.46102

>  <PCAT_CMPD_ID> (356)
WAY-303376

>  <CNC_ID> (356)
359394556

>  <transfer_container_id> (356)
PTN000000072

>  <COMPOUND_NUMBER> (356)
WAY-303376

>  <BAR_CODE_NO> (356)
3906235

>  <LOCATION_CODE> (356)
PTNCS

>  <AMOUNT_CURRENT> (356)
33.3

$$$$
WAY-303382
csChFnd80/10111816222D

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    0.5172    1.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8793    0.4690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1586    1.7241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8793    1.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2345    0.6862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2345    1.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
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 19 22  2  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
 19 20  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (357)
357

>  <Formula> (357)
C19H21N5O

>  <MolWeight> (357)
335.40294

>  <PCAT_CMPD_ID> (357)
WAY-303382

>  <CNC_ID> (357)
359394562

>  <transfer_container_id> (357)
PTN000000072

>  <COMPOUND_NUMBER> (357)
WAY-303382

>  <BAR_CODE_NO> (357)
3906241

>  <LOCATION_CODE> (357)
PTNCS

>  <AMOUNT_CURRENT> (357)
33.6

$$$$
WAY-303388
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.2125    1.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8125    2.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4125    2.1958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3958    1.5125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0958    2.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0958    2.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  9  1  0  0  0  0
  7  3  1  0  0  0  0
  8  6  2  0  0  0  0
  9  1  1  0  0  0  0
 10  2  1  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  7  2  0  0  0  0
 16 14  2  0  0  0  0
 17 14  1  0  0  0  0
 18 12  1  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21 19  2  0  0  0  0
 22 18  2  0  0  0  0
  8  7  1  0  0  0  0
 12 13  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (358)
358

>  <Formula> (358)
C14H12N4O4

>  <MolWeight> (358)
300.26948

>  <PCAT_CMPD_ID> (358)
WAY-303388

>  <CNC_ID> (358)
359394568

>  <transfer_container_id> (358)
PTN000000072

>  <COMPOUND_NUMBER> (358)
WAY-303388

>  <BAR_CODE_NO> (358)
3906247

>  <LOCATION_CODE> (358)
PTNCS

>  <AMOUNT_CURRENT> (358)
33.6

$$$$
WAY-303408
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.6414   -0.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4759   -0.3343    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2310    0.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2310   -1.0446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4138    0.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.0862    1.0933    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  8 11  2  0  0  0  0
  9 10  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (359)
359

>  <Formula> (359)
C15H15BrN2O2

>  <MolWeight> (359)
335.1958

>  <PCAT_CMPD_ID> (359)
WAY-303408

>  <CNC_ID> (359)
359394588

>  <transfer_container_id> (359)
PTN000000072

>  <COMPOUND_NUMBER> (359)
WAY-303408

>  <BAR_CODE_NO> (359)
3906267

>  <LOCATION_CODE> (359)
PTNCS

>  <AMOUNT_CURRENT> (359)
33.8

$$$$
WAY-303410-A
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.8414   -0.6353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8414    0.1958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1379   -1.0560    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5414   -1.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3931   -0.6353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
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  4 10  1  0  0  0  0
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  7 14  2  0  0  0  0
  8 15  1  0  0  0  0
 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7 11  1  0  0  0  0
  9 13  2  0  0  0  0
 10 15  1  0  0  0  0
M  END
>  <Mol_ID> (360)
360

>  <Formula> (360)
C19H25N3O3

>  <MolWeight> (360)
343.4201

>  <PCAT_CMPD_ID> (360)
WAY-303410-A

>  <CNC_ID> (360)
359394590

>  <transfer_container_id> (360)
PTN000000072

>  <COMPOUND_NUMBER> (360)
WAY-303410-A

>  <BAR_CODE_NO> (360)
3906270

>  <LOCATION_CODE> (360)
PTNCS

>  <AMOUNT_CURRENT> (360)
33.4

$$$$
WAY-303413
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 16  2  0  0  0  0
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 13 18  2  0  0  0  0
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 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
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 20 26  2  0  0  0  0
 22 27  1  0  0  0  0
 22 28  1  0  0  0  0
  9 10  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
M  END
>  <Mol_ID> (361)
361

>  <Formula> (361)
C19H20N4O4S

>  <MolWeight> (361)
400.4515

>  <PCAT_CMPD_ID> (361)
WAY-303413

>  <CNC_ID> (361)
359394593

>  <transfer_container_id> (361)
PTN000000072

>  <COMPOUND_NUMBER> (361)
WAY-303413

>  <BAR_CODE_NO> (361)
3906273

>  <LOCATION_CODE> (361)
PTNCS

>  <AMOUNT_CURRENT> (361)
33.4

$$$$
WAY-303420
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
    0.2000    0.7276    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
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 10 18  1  0  0  0  0
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 23 27  1  0  0  0  0
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 18 22  1  0  0  0  0
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 34 35  1  0  0  0  0
M  END
>  <Mol_ID> (362)
362

>  <Formula> (362)
C25H28FN7O2

>  <MolWeight> (362)
477.5339232

>  <PCAT_CMPD_ID> (362)
WAY-303420

>  <CNC_ID> (362)
359394600

>  <transfer_container_id> (362)
PTN000000072

>  <COMPOUND_NUMBER> (362)
WAY-303420

>  <BAR_CODE_NO> (362)
3906282

>  <LOCATION_CODE> (362)
PTNCS

>  <AMOUNT_CURRENT> (362)
33.1

$$$$
WAY-303422
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    1.6589    0.1688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  6  8  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (363)
363

>  <Formula> (363)
C17H15NO4

>  <MolWeight> (363)
297.3053

>  <PCAT_CMPD_ID> (363)
WAY-303422

>  <CNC_ID> (363)
359394602

>  <transfer_container_id> (363)
PTN000000072

>  <COMPOUND_NUMBER> (363)
WAY-303422

>  <BAR_CODE_NO> (363)
3906285

>  <LOCATION_CODE> (363)
PTNCS

>  <AMOUNT_CURRENT> (363)
33.7

$$$$
WAY-303430
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -1.5663   -1.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  2  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  2  0  0  0  0
 14 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
  5  7  2  0  0  0  0
 13 16  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (364)
364

>  <Formula> (364)
C17H16N4OS

>  <MolWeight> (364)
324.40014

>  <PCAT_CMPD_ID> (364)
WAY-303430

>  <CNC_ID> (364)
359394610

>  <transfer_container_id> (364)
PTN000000072

>  <COMPOUND_NUMBER> (364)
WAY-303430

>  <BAR_CODE_NO> (364)
3906296

>  <LOCATION_CODE> (364)
PTNCS

>  <AMOUNT_CURRENT> (364)
33

$$$$
WAY-303436
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -1.6655    0.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4172    0.4690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (365)
365

>  <Formula> (365)
C15H15N3O5

>  <MolWeight> (365)
317.2967

>  <PCAT_CMPD_ID> (365)
WAY-303436

>  <CNC_ID> (365)
359394616

>  <transfer_container_id> (365)
PTN000000072

>  <COMPOUND_NUMBER> (365)
WAY-303436

>  <BAR_CODE_NO> (365)
3906304

>  <LOCATION_CODE> (365)
PTNCS

>  <AMOUNT_CURRENT> (365)
33.4

$$$$
WAY-303439
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.0621   -0.2034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  5  8  1  0  0  0  0
  9 13  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (366)
366

>  <Formula> (366)
C16H20N2OS2

>  <MolWeight> (366)
320.4728

>  <PCAT_CMPD_ID> (366)
WAY-303439

>  <CNC_ID> (366)
359394619

>  <transfer_container_id> (366)
PTN000000072

>  <COMPOUND_NUMBER> (366)
WAY-303439

>  <BAR_CODE_NO> (366)
3906307

>  <LOCATION_CODE> (366)
PTNCS

>  <AMOUNT_CURRENT> (366)
33.8

$$$$
WAY-303441
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
    1.2508   -0.8243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (367)
367

>  <Formula> (367)
C11H12N2OS

>  <MolWeight> (367)
220.29078

>  <PCAT_CMPD_ID> (367)
WAY-303441

>  <CNC_ID> (367)
359394621

>  <transfer_container_id> (367)
PTN000000072

>  <COMPOUND_NUMBER> (367)
WAY-303441

>  <BAR_CODE_NO> (367)
3906311

>  <LOCATION_CODE> (367)
PTNCS

>  <AMOUNT_CURRENT> (367)
33.2

$$$$
WAY-303451
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 23 26  1  0  0  0  0
 31 32  2  0  0  0  0
M  END
>  <Mol_ID> (368)
368

>  <Formula> (368)
C26H24N2O4

>  <MolWeight> (368)
428.47976

>  <PCAT_CMPD_ID> (368)
WAY-303451

>  <CNC_ID> (368)
359394631

>  <transfer_container_id> (368)
PTN000000072

>  <COMPOUND_NUMBER> (368)
WAY-303451

>  <BAR_CODE_NO> (368)
3906325

>  <LOCATION_CODE> (368)
PTNCS

>  <AMOUNT_CURRENT> (368)
33.5

$$$$
WAY-303454
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 17 18  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (369)
369

>  <Formula> (369)
C19H22N2O5S

>  <MolWeight> (369)
390.45338

>  <PCAT_CMPD_ID> (369)
WAY-303454

>  <CNC_ID> (369)
359394634

>  <transfer_container_id> (369)
PTN000000072

>  <COMPOUND_NUMBER> (369)
WAY-303454

>  <BAR_CODE_NO> (369)
3906332

>  <LOCATION_CODE> (369)
PTNCS

>  <AMOUNT_CURRENT> (369)
33.9

$$$$
WAY-303466
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 10 11  1  0  0  0  0
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (370)
370

>  <Formula> (370)
C12H8N2OS2

>  <MolWeight> (370)
260.33472

>  <PCAT_CMPD_ID> (370)
WAY-303466

>  <CNC_ID> (370)
359394646

>  <transfer_container_id> (370)
PTN000000072

>  <COMPOUND_NUMBER> (370)
WAY-303466

>  <BAR_CODE_NO> (370)
3906347

>  <LOCATION_CODE> (370)
PTNCS

>  <AMOUNT_CURRENT> (370)
33.6

$$$$
WAY-303468
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (371)
371

>  <Formula> (371)
C17H18N2O3

>  <MolWeight> (371)
298.33642

>  <PCAT_CMPD_ID> (371)
WAY-303468

>  <CNC_ID> (371)
359394648

>  <transfer_container_id> (371)
PTN000000072

>  <COMPOUND_NUMBER> (371)
WAY-303468

>  <BAR_CODE_NO> (371)
3906349

>  <LOCATION_CODE> (371)
PTNCS

>  <AMOUNT_CURRENT> (371)
33.4

$$$$
WAY-303473
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (372)
372

>  <Formula> (372)
C20H18BrNO3

>  <MolWeight> (372)
400.26582

>  <PCAT_CMPD_ID> (372)
WAY-303473

>  <CNC_ID> (372)
359394653

>  <transfer_container_id> (372)
PTN000000072

>  <COMPOUND_NUMBER> (372)
WAY-303473

>  <BAR_CODE_NO> (372)
3906354

>  <LOCATION_CODE> (372)
PTNCS

>  <AMOUNT_CURRENT> (372)
33.8

$$$$
WAY-303494-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (373)
373

>  <Formula> (373)
C19H23FN2O

>  <MolWeight> (373)
314.3971232

>  <PCAT_CMPD_ID> (373)
WAY-303494-A

>  <CNC_ID> (373)
359394674

>  <transfer_container_id> (373)
PTN000000072

>  <COMPOUND_NUMBER> (373)
WAY-303494-A

>  <BAR_CODE_NO> (373)
3906379

>  <LOCATION_CODE> (373)
PTNCS

>  <AMOUNT_CURRENT> (373)
33.3

$$$$
WAY-303862
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (374)
374

>  <Formula> (374)
C18H21N3OS2

>  <MolWeight> (374)
359.50884

>  <PCAT_CMPD_ID> (374)
WAY-303862

>  <CNC_ID> (374)
359395042

>  <transfer_container_id> (374)
PTN000000072

>  <COMPOUND_NUMBER> (374)
WAY-303862

>  <BAR_CODE_NO> (374)
3906830

>  <LOCATION_CODE> (374)
PTNCS

>  <AMOUNT_CURRENT> (374)
33.4

$$$$
WAY-303863
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (375)
375

>  <Formula> (375)
C23H23N3O2S

>  <MolWeight> (375)
405.51262

>  <PCAT_CMPD_ID> (375)
WAY-303863

>  <CNC_ID> (375)
359395043

>  <transfer_container_id> (375)
PTN000000072

>  <COMPOUND_NUMBER> (375)
WAY-303863

>  <BAR_CODE_NO> (375)
3906831

>  <LOCATION_CODE> (375)
PTNCS

>  <AMOUNT_CURRENT> (375)
33.1

$$$$
WAY-303864
csChFnd80/10111816222D

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 23 24  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (376)
376

>  <Formula> (376)
C24H25N3O3S

>  <MolWeight> (376)
435.5386

>  <PCAT_CMPD_ID> (376)
WAY-303864

>  <CNC_ID> (376)
359395044

>  <transfer_container_id> (376)
PTN000000072

>  <COMPOUND_NUMBER> (376)
WAY-303864

>  <BAR_CODE_NO> (376)
3906832

>  <LOCATION_CODE> (376)
PTNCS

>  <AMOUNT_CURRENT> (376)
33.6

$$$$
WAY-303889
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
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  8 15  2  0  0  0  0
 10 16  1  0  0  0  0
 12 17  1  0  0  0  0
 12 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
  9 10  1  0  0  0  0
 24 25  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (377)
377

>  <Formula> (377)
C18H20N2O7S

>  <MolWeight> (377)
408.4256

>  <PCAT_CMPD_ID> (377)
WAY-303889

>  <CNC_ID> (377)
359395068

>  <transfer_container_id> (377)
PTN000000072

>  <COMPOUND_NUMBER> (377)
WAY-303889

>  <BAR_CODE_NO> (377)
3906866

>  <LOCATION_CODE> (377)
PTNCS

>  <AMOUNT_CURRENT> (377)
33.8

$$$$
WAY-303905
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.9172   -0.6793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
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  6 10  1  0  0  0  0
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  8 13  1  0  0  0  0
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 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  2  0  0  0  0
 21 23  2  0  0  0  0
  8 11  2  0  0  0  0
  9 10  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (378)
378

>  <Formula> (378)
C16H15N3O4

>  <MolWeight> (378)
313.308

>  <PCAT_CMPD_ID> (378)
WAY-303905

>  <CNC_ID> (378)
359395084

>  <transfer_container_id> (378)
PTN000000072

>  <COMPOUND_NUMBER> (378)
WAY-303905

>  <BAR_CODE_NO> (378)
3906885

>  <LOCATION_CODE> (378)
PTNCS

>  <AMOUNT_CURRENT> (378)
33.2

$$$$
WAY-303907
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  5  1  0  0  0  0
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  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
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 13 16  1  0  0  0  0
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 28 29  1  0  0  0  0
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 12 14  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (379)
379

>  <Formula> (379)
C20H17F3N2O3S

>  <MolWeight> (379)
422.4207896

>  <PCAT_CMPD_ID> (379)
WAY-303907

>  <CNC_ID> (379)
359395086

>  <transfer_container_id> (379)
PTN000000072

>  <COMPOUND_NUMBER> (379)
WAY-303907

>  <BAR_CODE_NO> (379)
3906889

>  <LOCATION_CODE> (379)
PTNCS

>  <AMOUNT_CURRENT> (379)
33.6

$$$$
WAY-303908
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
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  9 10  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (380)
380

>  <Formula> (380)
C16H16BrN3O

>  <MolWeight> (380)
346.22174

>  <PCAT_CMPD_ID> (380)
WAY-303908

>  <CNC_ID> (380)
359395087

>  <transfer_container_id> (380)
PTN000000072

>  <COMPOUND_NUMBER> (380)
WAY-303908

>  <BAR_CODE_NO> (380)
3906890

>  <LOCATION_CODE> (380)
PTNCS

>  <AMOUNT_CURRENT> (380)
33

$$$$
WAY-303922
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (381)
381

>  <Formula> (381)
C15H17F3N2O2

>  <MolWeight> (381)
314.3028896

>  <PCAT_CMPD_ID> (381)
WAY-303922

>  <CNC_ID> (381)
359395101

>  <transfer_container_id> (381)
PTN000000072

>  <COMPOUND_NUMBER> (381)
WAY-303922

>  <BAR_CODE_NO> (381)
3906906

>  <LOCATION_CODE> (381)
PTNCS

>  <AMOUNT_CURRENT> (381)
33.2

$$$$
WAY-303956
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (382)
382

>  <Formula> (382)
C21H22F3N5O3

>  <MolWeight> (382)
449.4262896

>  <PCAT_CMPD_ID> (382)
WAY-303956

>  <CNC_ID> (382)
359395135

>  <transfer_container_id> (382)
PTN000000072

>  <COMPOUND_NUMBER> (382)
WAY-303956

>  <BAR_CODE_NO> (382)
3906940

>  <LOCATION_CODE> (382)
PTNCS

>  <AMOUNT_CURRENT> (382)
33.4

$$$$
WAY-303967
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (383)
383

>  <Formula> (383)
C12H12N2O3S2

>  <MolWeight> (383)
296.36528

>  <PCAT_CMPD_ID> (383)
WAY-303967

>  <CNC_ID> (383)
359395146

>  <transfer_container_id> (383)
PTN000000072

>  <COMPOUND_NUMBER> (383)
WAY-303967

>  <BAR_CODE_NO> (383)
3906953

>  <LOCATION_CODE> (383)
PTNCS

>  <AMOUNT_CURRENT> (383)
33.3

$$$$
WAY-303993
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (384)
384

>  <Formula> (384)
C19H24N4O2S

>  <MolWeight> (384)
372.48446

>  <PCAT_CMPD_ID> (384)
WAY-303993

>  <CNC_ID> (384)
359395171

>  <transfer_container_id> (384)
PTN000000072

>  <COMPOUND_NUMBER> (384)
WAY-303993

>  <BAR_CODE_NO> (384)
3906989

>  <LOCATION_CODE> (384)
PTNCS

>  <AMOUNT_CURRENT> (384)
33.6

$$$$
WAY-304015
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (385)
385

>  <Formula> (385)
C18H18N2O4

>  <MolWeight> (385)
326.34652

>  <PCAT_CMPD_ID> (385)
WAY-304015

>  <CNC_ID> (385)
359395193

>  <transfer_container_id> (385)
PTN000000072

>  <COMPOUND_NUMBER> (385)
WAY-304015

>  <BAR_CODE_NO> (385)
3907014

>  <LOCATION_CODE> (385)
PTNCS

>  <AMOUNT_CURRENT> (385)
33.3

$$$$
WAY-304028
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (386)
386

>  <Formula> (386)
C20H17NO6S

>  <MolWeight> (386)
399.41708

>  <PCAT_CMPD_ID> (386)
WAY-304028

>  <CNC_ID> (386)
359395206

>  <transfer_container_id> (386)
PTN000000072

>  <COMPOUND_NUMBER> (386)
WAY-304028

>  <BAR_CODE_NO> (386)
3907028

>  <LOCATION_CODE> (386)
PTNCS

>  <AMOUNT_CURRENT> (386)
33.4

$$$$
WAY-304036
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (387)
387

>  <Formula> (387)
C12H15N3OS

>  <MolWeight> (387)
249.332

>  <PCAT_CMPD_ID> (387)
WAY-304036

>  <CNC_ID> (387)
359395214

>  <transfer_container_id> (387)
PTN000000072

>  <COMPOUND_NUMBER> (387)
WAY-304036

>  <BAR_CODE_NO> (387)
3907042

>  <LOCATION_CODE> (387)
PTNCS

>  <AMOUNT_CURRENT> (387)
33.7

$$$$
WAY-304041
csChFnd80/10111816222D

 24 28  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
 12 14  2  0  0  0  0
 18 20  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (388)
388

>  <Formula> (388)
C20H13NO2S

>  <MolWeight> (388)
331.38772

>  <PCAT_CMPD_ID> (388)
WAY-304041

>  <CNC_ID> (388)
359395219

>  <transfer_container_id> (388)
PTN000000072

>  <COMPOUND_NUMBER> (388)
WAY-304041

>  <BAR_CODE_NO> (388)
3907049

>  <LOCATION_CODE> (388)
PTNCS

>  <AMOUNT_CURRENT> (388)
33.3

$$$$
WAY-304051-A
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (389)
389

>  <Formula> (389)
C15H20F2N2O

>  <MolWeight> (389)
282.3289064

>  <PCAT_CMPD_ID> (389)
WAY-304051-A

>  <CNC_ID> (389)
359395229

>  <transfer_container_id> (389)
PTN000000072

>  <COMPOUND_NUMBER> (389)
WAY-304051-A

>  <BAR_CODE_NO> (389)
3907062

>  <LOCATION_CODE> (389)
PTNCS

>  <AMOUNT_CURRENT> (389)
33.6

$$$$
WAY-304053
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 16 17  2  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (390)
390

>  <Formula> (390)
C18H17ClN2O3

>  <MolWeight> (390)
344.79218

>  <PCAT_CMPD_ID> (390)
WAY-304053

>  <CNC_ID> (390)
359395231

>  <transfer_container_id> (390)
PTN000000072

>  <COMPOUND_NUMBER> (390)
WAY-304053

>  <BAR_CODE_NO> (390)
3907064

>  <LOCATION_CODE> (390)
PTNCS

>  <AMOUNT_CURRENT> (390)
33.7

$$$$
WAY-304062
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (391)
391

>  <Formula> (391)
C17H14N2O4S2

>  <MolWeight> (391)
374.43406

>  <PCAT_CMPD_ID> (391)
WAY-304062

>  <CNC_ID> (391)
359395240

>  <transfer_container_id> (391)
PTN000000072

>  <COMPOUND_NUMBER> (391)
WAY-304062

>  <BAR_CODE_NO> (391)
3907073

>  <LOCATION_CODE> (391)
PTNCS

>  <AMOUNT_CURRENT> (391)
33.2

$$$$
WAY-304063
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (392)
392

>  <Formula> (392)
C13H15Cl2NO

>  <MolWeight> (392)
272.1703

>  <PCAT_CMPD_ID> (392)
WAY-304063

>  <CNC_ID> (392)
359395241

>  <transfer_container_id> (392)
PTN000000072

>  <COMPOUND_NUMBER> (392)
WAY-304063

>  <BAR_CODE_NO> (392)
3907074

>  <LOCATION_CODE> (392)
PTNCS

>  <AMOUNT_CURRENT> (392)
33.8

$$$$
WAY-304084
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  5  7  1  0  0  0  0
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (393)
393

>  <Formula> (393)
C16H13NO2S

>  <MolWeight> (393)
283.34492

>  <PCAT_CMPD_ID> (393)
WAY-304084

>  <CNC_ID> (393)
359395262

>  <transfer_container_id> (393)
PTN000000072

>  <COMPOUND_NUMBER> (393)
WAY-304084

>  <BAR_CODE_NO> (393)
3907100

>  <LOCATION_CODE> (393)
PTNCS

>  <AMOUNT_CURRENT> (393)
33.3

$$$$
WAY-304097
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 21 23  1  0  0  0  0
  8  9  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (394)
394

>  <Formula> (394)
C17H20N2O4

>  <MolWeight> (394)
316.3517

>  <PCAT_CMPD_ID> (394)
WAY-304097

>  <CNC_ID> (394)
359395275

>  <transfer_container_id> (394)
PTN000000072

>  <COMPOUND_NUMBER> (394)
WAY-304097

>  <BAR_CODE_NO> (394)
3907115

>  <LOCATION_CODE> (394)
PTNCS

>  <AMOUNT_CURRENT> (394)
33.7

$$$$
WAY-304106
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 18 20  2  0  0  0  0
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  9 10  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (395)
395

>  <Formula> (395)
C18H17N3O

>  <MolWeight> (395)
291.34708

>  <PCAT_CMPD_ID> (395)
WAY-304106

>  <CNC_ID> (395)
359395284

>  <transfer_container_id> (395)
PTN000000072

>  <COMPOUND_NUMBER> (395)
WAY-304106

>  <BAR_CODE_NO> (395)
3907127

>  <LOCATION_CODE> (395)
PTNCS

>  <AMOUNT_CURRENT> (395)
33.7

$$$$
WAY-304108
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 19 21  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (396)
396

>  <Formula> (396)
C22H26N4O

>  <MolWeight> (396)
362.46804

>  <PCAT_CMPD_ID> (396)
WAY-304108

>  <CNC_ID> (396)
359395286

>  <transfer_container_id> (396)
PTN000000072

>  <COMPOUND_NUMBER> (396)
WAY-304108

>  <BAR_CODE_NO> (396)
3907129

>  <LOCATION_CODE> (396)
PTNCS

>  <AMOUNT_CURRENT> (396)
33.2

$$$$
WAY-304109-A
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 19 22  1  0  0  0  0
M  END
>  <Mol_ID> (397)
397

>  <Formula> (397)
C18H20N4

>  <MolWeight> (397)
292.3782

>  <PCAT_CMPD_ID> (397)
WAY-304109-A

>  <CNC_ID> (397)
359395287

>  <transfer_container_id> (397)
PTN000000072

>  <COMPOUND_NUMBER> (397)
WAY-304109-A

>  <BAR_CODE_NO> (397)
3907130

>  <LOCATION_CODE> (397)
PTNCS

>  <AMOUNT_CURRENT> (397)
33.4

$$$$
WAY-304111-A
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
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 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 17 21  2  0  0  0  0
 18 22  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
 19 22  2  0  0  0  0
M  END
>  <Mol_ID> (398)
398

>  <Formula> (398)
C17H15N3O2

>  <MolWeight> (398)
293.3199

>  <PCAT_CMPD_ID> (398)
WAY-304111-A

>  <CNC_ID> (398)
359395289

>  <transfer_container_id> (398)
PTN000000072

>  <COMPOUND_NUMBER> (398)
WAY-304111-A

>  <BAR_CODE_NO> (398)
3907132

>  <LOCATION_CODE> (398)
PTNCS

>  <AMOUNT_CURRENT> (398)
33.5

$$$$
WAY-304116
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <Mol_ID> (399)
399

>  <Formula> (399)
C14H21N3O3

>  <MolWeight> (399)
279.33484

>  <PCAT_CMPD_ID> (399)
WAY-304116

>  <CNC_ID> (399)
359395294

>  <transfer_container_id> (399)
PTN000000072

>  <COMPOUND_NUMBER> (399)
WAY-304116

>  <BAR_CODE_NO> (399)
3907139

>  <LOCATION_CODE> (399)
PTNCS

>  <AMOUNT_CURRENT> (399)
33.9

$$$$
WAY-304122
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.1134    2.8280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  7  1  0  0  0  0
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 13  2  1  0  0  0  0
 14  5  1  0  0  0  0
 15  8  2  0  0  0  0
 16  8  1  0  0  0  0
 17 10  1  0  0  0  0
 18 10  1  0  0  0  0
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 20 14  1  0  0  0  0
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 23 20  1  0  0  0  0
 24 19  1  0  0  0  0
 25 23  1  0  0  0  0
  4  6  1  0  0  0  0
 25 24  1  0  0  0  0
 10  9  1  0  0  0  0
M  END
>  <Mol_ID> (400)
400

>  <Formula> (400)
C20H29NO4

>  <MolWeight> (400)
347.44856

>  <PCAT_CMPD_ID> (400)
WAY-304122

>  <CNC_ID> (400)
359395300

>  <transfer_container_id> (400)
PTN000000072

>  <COMPOUND_NUMBER> (400)
WAY-304122

>  <BAR_CODE_NO> (400)
3907145

>  <LOCATION_CODE> (400)
PTNCS

>  <AMOUNT_CURRENT> (400)
33.3

$$$$
WAY-304150
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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M  END
>  <Mol_ID> (401)
401

>  <Formula> (401)
C22H22N2O2

>  <MolWeight> (401)
346.42228

>  <PCAT_CMPD_ID> (401)
WAY-304150

>  <CNC_ID> (401)
359395328

>  <transfer_container_id> (401)
PTN000000072

>  <COMPOUND_NUMBER> (401)
WAY-304150

>  <BAR_CODE_NO> (401)
3907179

>  <LOCATION_CODE> (401)
PTNCS

>  <AMOUNT_CURRENT> (401)
33.4

$$$$
WAY-304160
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (402)
402

>  <Formula> (402)
C14H18N2O3

>  <MolWeight> (402)
262.30432

>  <PCAT_CMPD_ID> (402)
WAY-304160

>  <CNC_ID> (402)
359395338

>  <transfer_container_id> (402)
PTN000000072

>  <COMPOUND_NUMBER> (402)
WAY-304160

>  <BAR_CODE_NO> (402)
3907191

>  <LOCATION_CODE> (402)
PTNCS

>  <AMOUNT_CURRENT> (402)
33.8

$$$$
WAY-304163
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  1  6  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
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  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
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  5  6  1  0  0  0  0
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  7  8  2  0  0  0  0
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 11 25  1  0  0  0  0
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 22 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 28  2  0  0  0  0
M  END
>  <Mol_ID> (403)
403

>  <Formula> (403)
C22H20N2O4

>  <MolWeight> (403)
376.4052

>  <PCAT_CMPD_ID> (403)
WAY-304163

>  <CNC_ID> (403)
359395341

>  <transfer_container_id> (403)
PTN000000072

>  <COMPOUND_NUMBER> (403)
WAY-304163

>  <BAR_CODE_NO> (403)
3907195

>  <LOCATION_CODE> (403)
PTNCS

>  <AMOUNT_CURRENT> (403)
33.7

$$$$
WAY-304191
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.9034    0.6069    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  8 13  1  0  0  0  0
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  9 15  1  0  0  0  0
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 15 17  2  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
  6  7  1  0  0  0  0
  8 11  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (404)
404

>  <Formula> (404)
C18H25NO2

>  <MolWeight> (404)
287.3966

>  <PCAT_CMPD_ID> (404)
WAY-304191

>  <CNC_ID> (404)
359395369

>  <transfer_container_id> (404)
PRL000000080

>  <COMPOUND_NUMBER> (404)
WAY-304191

>  <BAR_CODE_NO> (404)
3937239

>  <LOCATION_CODE> (404)
PRLCS

>  <AMOUNT_CURRENT> (404)
33.6

$$$$
WAY-304195
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 10 15  2  0  0  0  0
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 13 18  1  0  0  0  0
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 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
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 17 18  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (405)
405

>  <Formula> (405)
C17H17ClN2O4S

>  <MolWeight> (405)
380.84588

>  <PCAT_CMPD_ID> (405)
WAY-304195

>  <CNC_ID> (405)
359395373

>  <transfer_container_id> (405)
PTN000000072

>  <COMPOUND_NUMBER> (405)
WAY-304195

>  <BAR_CODE_NO> (405)
3907246

>  <LOCATION_CODE> (405)
PTNCS

>  <AMOUNT_CURRENT> (405)
33.3

$$$$
WAY-304197
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 21 24  2  0  0  0  0
  8  9  1  0  0  0  0
 14 17  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (406)
406

>  <Formula> (406)
C15H15ClN2O4S2

>  <MolWeight> (406)
386.8736

>  <PCAT_CMPD_ID> (406)
WAY-304197

>  <CNC_ID> (406)
359395375

>  <transfer_container_id> (406)
PTN000000072

>  <COMPOUND_NUMBER> (406)
WAY-304197

>  <BAR_CODE_NO> (406)
3907249

>  <LOCATION_CODE> (406)
PTNCS

>  <AMOUNT_CURRENT> (406)
33

$$$$
WAY-304202
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 15 17  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (407)
407

>  <Formula> (407)
C16H16ClN5O3

>  <MolWeight> (407)
361.78294

>  <PCAT_CMPD_ID> (407)
WAY-304202

>  <CNC_ID> (407)
359395380

>  <transfer_container_id> (407)
PTN000000072

>  <COMPOUND_NUMBER> (407)
WAY-304202

>  <BAR_CODE_NO> (407)
3907254

>  <LOCATION_CODE> (407)
PTNCS

>  <AMOUNT_CURRENT> (407)
33.4

$$$$
WAY-304207
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11 16  2  0  0  0  0
 13 17  2  0  0  0  0
 15 18  2  0  0  0  0
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 18 20  1  0  0  0  0
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 20 22  2  0  0  0  0
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 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (408)
408

>  <Formula> (408)
C19H15FN2O

>  <MolWeight> (408)
306.3336032

>  <PCAT_CMPD_ID> (408)
WAY-304207

>  <CNC_ID> (408)
359395385

>  <transfer_container_id> (408)
PTN000000072

>  <COMPOUND_NUMBER> (408)
WAY-304207

>  <BAR_CODE_NO> (408)
3907260

>  <LOCATION_CODE> (408)
PTNCS

>  <AMOUNT_CURRENT> (408)
33.1

$$$$
WAY-304216
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
   -0.2989    0.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (409)
409

>  <Formula> (409)
C8H9N3S2

>  <MolWeight> (409)
211.30716

>  <PCAT_CMPD_ID> (409)
WAY-304216

>  <CNC_ID> (409)
359395394

>  <transfer_container_id> (409)
PTN000000072

>  <COMPOUND_NUMBER> (409)
WAY-304216

>  <BAR_CODE_NO> (409)
3907271

>  <LOCATION_CODE> (409)
PTNCS

>  <AMOUNT_CURRENT> (409)
33.5

$$$$
WAY-304221
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (410)
410

>  <Formula> (410)
C15H19BrN2O

>  <MolWeight> (410)
323.22816

>  <PCAT_CMPD_ID> (410)
WAY-304221

>  <CNC_ID> (410)
359395399

>  <transfer_container_id> (410)
PTN000000072

>  <COMPOUND_NUMBER> (410)
WAY-304221

>  <BAR_CODE_NO> (410)
3907278

>  <LOCATION_CODE> (410)
PTNCS

>  <AMOUNT_CURRENT> (410)
33.6

$$$$
WAY-304233
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (411)
411

>  <Formula> (411)
C20H21N3O5S

>  <MolWeight> (411)
415.46284

>  <PCAT_CMPD_ID> (411)
WAY-304233

>  <CNC_ID> (411)
359395410

>  <transfer_container_id> (411)
PTN000000072

>  <COMPOUND_NUMBER> (411)
WAY-304233

>  <BAR_CODE_NO> (411)
3907296

>  <LOCATION_CODE> (411)
PTNCS

>  <AMOUNT_CURRENT> (411)
33.5

$$$$
WAY-304242
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (412)
412

>  <Formula> (412)
C11H13ClN2O5S

>  <MolWeight> (412)
320.74932

>  <PCAT_CMPD_ID> (412)
WAY-304242

>  <CNC_ID> (412)
359395419

>  <transfer_container_id> (412)
PTN000000072

>  <COMPOUND_NUMBER> (412)
WAY-304242

>  <BAR_CODE_NO> (412)
3907306

>  <LOCATION_CODE> (412)
PTNCS

>  <AMOUNT_CURRENT> (412)
33

$$$$
WAY-304258
csChFnd80/10111816222D

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 11 13  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (413)
413

>  <Formula> (413)
C16H14FN5O2

>  <MolWeight> (413)
327.3130632

>  <PCAT_CMPD_ID> (413)
WAY-304258

>  <CNC_ID> (413)
359395435

>  <transfer_container_id> (413)
PTN000000072

>  <COMPOUND_NUMBER> (413)
WAY-304258

>  <BAR_CODE_NO> (413)
3907323

>  <LOCATION_CODE> (413)
PTNCS

>  <AMOUNT_CURRENT> (413)
33

$$$$
WAY-304261
csChFnd80/10111816222D

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 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (414)
414

>  <Formula> (414)
C17H13N3O4

>  <MolWeight> (414)
323.30282

>  <PCAT_CMPD_ID> (414)
WAY-304261

>  <CNC_ID> (414)
359395438

>  <transfer_container_id> (414)
PTN000000072

>  <COMPOUND_NUMBER> (414)
WAY-304261

>  <BAR_CODE_NO> (414)
3907326

>  <LOCATION_CODE> (414)
PTNCS

>  <AMOUNT_CURRENT> (414)
33.3

$$$$
WAY-304277
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (415)
415

>  <Formula> (415)
C24H18N2O2

>  <MolWeight> (415)
366.41192

>  <PCAT_CMPD_ID> (415)
WAY-304277

>  <CNC_ID> (415)
359395454

>  <transfer_container_id> (415)
PTN000000072

>  <COMPOUND_NUMBER> (415)
WAY-304277

>  <BAR_CODE_NO> (415)
3907342

>  <LOCATION_CODE> (415)
PTNCS

>  <AMOUNT_CURRENT> (415)
33.9

$$$$
WAY-304288
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (416)
416

>  <Formula> (416)
C19H19ClN2O3

>  <MolWeight> (416)
358.81876

>  <PCAT_CMPD_ID> (416)
WAY-304288

>  <CNC_ID> (416)
359395465

>  <transfer_container_id> (416)
PTN000000072

>  <COMPOUND_NUMBER> (416)
WAY-304288

>  <BAR_CODE_NO> (416)
3907354

>  <LOCATION_CODE> (416)
PTNCS

>  <AMOUNT_CURRENT> (416)
33.8

$$$$
WAY-304290
csChFnd80/10111816222D

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  1  2  1  0  0  0  0
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 22 24  2  0  0  0  0
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 30 32  1  0  0  0  0
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 21 23  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (417)
417

>  <Formula> (417)
C26H25N3O3

>  <MolWeight> (417)
427.495

>  <PCAT_CMPD_ID> (417)
WAY-304290

>  <CNC_ID> (417)
359395467

>  <transfer_container_id> (417)
PTN000000072

>  <COMPOUND_NUMBER> (417)
WAY-304290

>  <BAR_CODE_NO> (417)
3907358

>  <LOCATION_CODE> (417)
PTNCS

>  <AMOUNT_CURRENT> (417)
33.7

$$$$
WAY-304303
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    0.3101    0.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
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 12 15  2  0  0  0  0
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 18 19  1  0  0  0  0
  5  6  2  0  0  0  0
 15 18  1  0  0  0  0
M  END
>  <Mol_ID> (418)
418

>  <Formula> (418)
C11H9BrN2O4S

>  <MolWeight> (418)
345.16916

>  <PCAT_CMPD_ID> (418)
WAY-304303

>  <CNC_ID> (418)
359395480

>  <transfer_container_id> (418)
PTN000000072

>  <COMPOUND_NUMBER> (418)
WAY-304303

>  <BAR_CODE_NO> (418)
3907376

>  <LOCATION_CODE> (418)
PTNCS

>  <AMOUNT_CURRENT> (418)
33

$$$$
WAY-304338
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  3  7  1  0  0  0  0
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 11 14  2  0  0  0  0
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 21 22  1  0  0  0  0
  7  9  1  0  0  0  0
 12 14  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (419)
419

>  <Formula> (419)
C16H12BrClN2O2

>  <MolWeight> (419)
379.63568

>  <PCAT_CMPD_ID> (419)
WAY-304338

>  <CNC_ID> (419)
359395515

>  <transfer_container_id> (419)
PTN000000072

>  <COMPOUND_NUMBER> (419)
WAY-304338

>  <BAR_CODE_NO> (419)
3907416

>  <LOCATION_CODE> (419)
PTNCS

>  <AMOUNT_CURRENT> (419)
33.3

$$$$
WAY-304360
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
  8 11  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (420)
420

>  <Formula> (420)
C15H15NO5

>  <MolWeight> (420)
289.2833

>  <PCAT_CMPD_ID> (420)
WAY-304360

>  <CNC_ID> (420)
359395537

>  <transfer_container_id> (420)
PRL000000080

>  <COMPOUND_NUMBER> (420)
WAY-304360

>  <BAR_CODE_NO> (420)
3937439

>  <LOCATION_CODE> (420)
PRLCS

>  <AMOUNT_CURRENT> (420)
33.5

$$$$
WAY-304388
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 25  7  1  0  0  0  0
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 13  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 13  2  0  0  0  0
 10 12  2  0  0  0  0
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 22 14  1  0  0  0  0
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 25 24  2  0  0  0  0
M  END
>  <Mol_ID> (421)
421

>  <Formula> (421)
C21H17N3O

>  <MolWeight> (421)
327.37918

>  <PCAT_CMPD_ID> (421)
WAY-304388

>  <CNC_ID> (421)
359395568

>  <transfer_container_id> (421)
PTN000000072

>  <COMPOUND_NUMBER> (421)
WAY-304388

>  <BAR_CODE_NO> (421)
3907471

>  <LOCATION_CODE> (421)
PTNCS

>  <AMOUNT_CURRENT> (421)
33.1

$$$$
WAY-304400
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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   -0.6961    2.5688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8869   -1.9372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  8  1  0  0  0  0
  6  2  1  0  0  0  0
  4  7  2  0  0  0  0
  8  2  1  0  0  0  0
  9 13  1  0  0  0  0
 10  5  2  0  0  0  0
 11 10  1  0  0  0  0
 12  5  1  0  0  0  0
 12 13  2  0  0  0  0
 14  9  1  0  0  0  0
 15 11  1  0  0  0  0
 14 16  2  0  0  0  0
 17 15  2  0  0  0  0
 18  3  2  0  0  0  0
 19  4  1  0  0  0  0
 20  7  1  0  0  0  0
 21 13  1  0  0  0  0
 22 16  1  0  0  0  0
 23 17  1  0  0  0  0
  7  6  1  0  0  0  0
 11  9  2  0  0  0  0
 17 16  1  0  0  0  0
M  END
>  <Mol_ID> (422)
422

>  <Formula> (422)
C17H19N5O

>  <MolWeight> (422)
309.36566

>  <PCAT_CMPD_ID> (422)
WAY-304400

>  <CNC_ID> (422)
359395580

>  <transfer_container_id> (422)
PTN000000072

>  <COMPOUND_NUMBER> (422)
WAY-304400

>  <BAR_CODE_NO> (422)
3907484

>  <LOCATION_CODE> (422)
PTNCS

>  <AMOUNT_CURRENT> (422)
33.4

$$$$
WAY-304405
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -0.2103    0.6724    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4414    0.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5862    1.3241    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.5138   -0.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7483   -0.1517    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0621    1.1931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3379    1.3172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8414   -2.6172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  7 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 20 22  2  0  0  0  0
  5  9  1  0  0  0  0
 16 19  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (423)
423

>  <Formula> (423)
C19H19NO2

>  <MolWeight> (423)
293.35966

>  <PCAT_CMPD_ID> (423)
WAY-304405

>  <CNC_ID> (423)
359395585

>  <transfer_container_id> (423)
PTN000000072

>  <COMPOUND_NUMBER> (423)
WAY-304405

>  <BAR_CODE_NO> (423)
3907490

>  <LOCATION_CODE> (423)
PTNCS

>  <AMOUNT_CURRENT> (423)
33.2

$$$$
WAY-304410
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.4446    1.7377    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1343    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4446    3.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1343   -0.5209    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
 10 12  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  2  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (424)
424

>  <Formula> (424)
C13H12ClN5O

>  <MolWeight> (424)
289.72028

>  <PCAT_CMPD_ID> (424)
WAY-304410

>  <CNC_ID> (424)
359395590

>  <transfer_container_id> (424)
PTN000000072

>  <COMPOUND_NUMBER> (424)
WAY-304410

>  <BAR_CODE_NO> (424)
3907495

>  <LOCATION_CODE> (424)
PTNCS

>  <AMOUNT_CURRENT> (424)
33.9

$$$$
WAY-304411
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
   -2.4825    1.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3066    0.3069    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2859    2.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 13 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
  5  7  2  0  0  0  0
  9 14  1  0  0  0  0
 15 17  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (425)
425

>  <Formula> (425)
C17H14N4OS

>  <MolWeight> (425)
322.38426

>  <PCAT_CMPD_ID> (425)
WAY-304411

>  <CNC_ID> (425)
359395591

>  <transfer_container_id> (425)
PTN000000072

>  <COMPOUND_NUMBER> (425)
WAY-304411

>  <BAR_CODE_NO> (425)
3907496

>  <LOCATION_CODE> (425)
PTNCS

>  <AMOUNT_CURRENT> (425)
33.3

$$$$
WAY-304413
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
    0.7853   -0.3162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 13  1  0  0  0  0
 11 12  1  0  0  0  0
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 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 11  1  0  0  0  0
 16  4  1  0  0  0  0
 17 14  2  0  0  0  0
 15 18  2  0  0  0  0
 19 10  2  0  0  0  0
 20 17  1  0  0  0  0
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 13 22  2  0  0  0  0
 23 20  1  0  0  0  0
 25 24  2  0  0  0  0
 25 22  1  0  0  0  0
  4 10  1  0  0  0  0
 19 24  1  0  0  0  0
 11  8  2  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (426)
426

>  <Formula> (426)
C18H15N5O2

>  <MolWeight> (426)
333.344

>  <PCAT_CMPD_ID> (426)
WAY-304413

>  <CNC_ID> (426)
359395593

>  <transfer_container_id> (426)
PTN000000072

>  <COMPOUND_NUMBER> (426)
WAY-304413

>  <BAR_CODE_NO> (426)
3907498

>  <LOCATION_CODE> (426)
PTNCS

>  <AMOUNT_CURRENT> (426)
33.1

$$$$
WAY-304439
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    0.4236    0.0718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 15 14  1  0  0  0  0
 16 14  1  0  0  0  0
 17 12  1  0  0  0  0
 18 13  1  0  0  0  0
  7  4  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (427)
427

>  <Formula> (427)
C13H18N2O3

>  <MolWeight> (427)
250.29362

>  <PCAT_CMPD_ID> (427)
WAY-304439

>  <CNC_ID> (427)
359395619

>  <transfer_container_id> (427)
PTN000000072

>  <COMPOUND_NUMBER> (427)
WAY-304439

>  <BAR_CODE_NO> (427)
3907529

>  <LOCATION_CODE> (427)
PTNCS

>  <AMOUNT_CURRENT> (427)
33.3

$$$$
WAY-304441
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    0.0414    0.3621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1103   -0.1103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4897    0.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3690    0.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6103   -0.1103    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2103   -0.4517    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7483    0.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6414    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7586    0.3690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3897    1.1414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2103   -0.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2207    0.2621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5897   -1.8517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0103   -1.8517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8897    1.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  2  0  0  0  0
 11 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 18 23  2  0  0  0  0
 19 24  2  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 22 27  1  0  0  0  0
  5  9  1  0  0  0  0
 13 17  1  0  0  0  0
 20 24  1  0  0  0  0
M  END
>  <Mol_ID> (428)
428

>  <Formula> (428)
C19H19N5O3

>  <MolWeight> (428)
365.38586

>  <PCAT_CMPD_ID> (428)
WAY-304441

>  <CNC_ID> (428)
359395621

>  <transfer_container_id> (428)
PTN000000072

>  <COMPOUND_NUMBER> (428)
WAY-304441

>  <BAR_CODE_NO> (428)
3907531

>  <LOCATION_CODE> (428)
PTNCS

>  <AMOUNT_CURRENT> (428)
33.6

$$$$
WAY-304457
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.4348   -0.6968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5624   -1.2140    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4348    0.4515    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3072   -1.2140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5624   -2.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1825   -1.2140    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3100    0.4515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3072   -2.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3100   -2.7588    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4348   -2.7588    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1825   -2.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3100    1.4826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1825   -0.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4451   -3.0761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1825    1.9964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0514    0.4515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1825    3.1446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3480    3.1446    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (429)
429

>  <Formula> (429)
C13H10F3N5

>  <MolWeight> (429)
293.2472096

>  <PCAT_CMPD_ID> (429)
WAY-304457

>  <CNC_ID> (429)
359395637

>  <transfer_container_id> (429)
PTN000000072

>  <COMPOUND_NUMBER> (429)
WAY-304457

>  <BAR_CODE_NO> (429)
3907547

>  <LOCATION_CODE> (429)
PTNCS

>  <AMOUNT_CURRENT> (429)
33.9

$$$$
WAY-304458
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    0.8895    0.2341    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8826   -0.3038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4205    0.5099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3929    0.4030    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3929   -0.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446   -0.6142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0519    0.2444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7067   -0.0349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5174    0.5134    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0519   -0.2935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2446   -0.0349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9933    0.2444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4588    0.5134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9933   -0.2935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9243    0.2513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4588   -0.5659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9243   -0.3038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
  5  8  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (430)
430

>  <Formula> (430)
C13H21N3O

>  <MolWeight> (430)
235.32534

>  <PCAT_CMPD_ID> (430)
WAY-304458

>  <CNC_ID> (430)
359395638

>  <transfer_container_id> (430)
PTN000000072

>  <COMPOUND_NUMBER> (430)
WAY-304458

>  <BAR_CODE_NO> (430)
3907550

>  <LOCATION_CODE> (430)
PTNCS

>  <AMOUNT_CURRENT> (430)
33.5

$$$$
WAY-304460
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
    0.7174   -0.1276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0140    0.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8071   -0.9483    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4761    0.2034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7101   -0.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0140    1.1172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6105   -1.1172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1933   -1.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0278   -0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4274    0.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7136   -0.9552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7067    1.5345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5722    1.5310    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  2  0  0  0  0
 14 18  2  0  0  0  0
 15 19  2  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
  7  9  2  0  0  0  0
 12 16  1  0  0  0  0
 18 19  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (431)
431

>  <Formula> (431)
C18H14N2O3

>  <MolWeight> (431)
306.31536

>  <PCAT_CMPD_ID> (431)
WAY-304460

>  <CNC_ID> (431)
359395640

>  <transfer_container_id> (431)
PTN000000072

>  <COMPOUND_NUMBER> (431)
WAY-304460

>  <BAR_CODE_NO> (431)
3907553

>  <LOCATION_CODE> (431)
PTNCS

>  <AMOUNT_CURRENT> (431)
33.8

$$$$
WAY-304480
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.1321   -0.1403    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1321    1.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8679   -0.7028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8679    1.5722    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8721   -0.1403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8721    1.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1321    1.5722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8679   -1.8486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8804   -0.1403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  2  0  0  0  0
  7  2  1  0  0  0  0
  8  3  2  0  0  0  0
  9  7  1  0  0  0  0
 10  7  2  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
 13  1  1  0  0  0  0
 14  5  1  0  0  0  0
 15 13  1  0  0  0  0
 16  6  1  0  0  0  0
 17 18  1  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 20 14  2  0  0  0  0
 21 16  2  0  0  0  0
  6  4  1  0  0  0  0
 11 12  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (432)
432

>  <Formula> (432)
C16H16N2O3

>  <MolWeight> (432)
284.30984

>  <PCAT_CMPD_ID> (432)
WAY-304480

>  <CNC_ID> (432)
359395660

>  <transfer_container_id> (432)
PTN000000072

>  <COMPOUND_NUMBER> (432)
WAY-304480

>  <BAR_CODE_NO> (432)
3907577

>  <LOCATION_CODE> (432)
PTNCS

>  <AMOUNT_CURRENT> (432)
33.5

$$$$
WAY-304489
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.3414    1.0724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8000    0.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0897    0.9931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0310    1.7414    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8897   -0.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  5  9  2  0  0  0  0
 13 15  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (433)
433

>  <Formula> (433)
C16H15N5O2S

>  <MolWeight> (433)
341.3876

>  <PCAT_CMPD_ID> (433)
WAY-304489

>  <CNC_ID> (433)
359395669

>  <transfer_container_id> (433)
PTN000000072

>  <COMPOUND_NUMBER> (433)
WAY-304489

>  <BAR_CODE_NO> (433)
3907589

>  <LOCATION_CODE> (433)
PTNCS

>  <AMOUNT_CURRENT> (433)
33.4

$$$$
WAY-304501
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -0.9379    0.2655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
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  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
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 11 16  1  0  0  0  0
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 12 18  1  0  0  0  0
 13 19  2  0  0  0  0
 16 20  2  0  0  0  0
 16 21  1  0  0  0  0
 17 22  1  0  0  0  0
 18 23  2  0  0  0  0
 20 24  1  0  0  0  0
 21 25  2  0  0  0  0
 22 26  2  0  0  0  0
 24 27  2  0  0  0  0
 24 28  1  0  0  0  0
  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
M  END
>  <Mol_ID> (434)
434

>  <Formula> (434)
C21H21N5O2

>  <MolWeight> (434)
375.42374

>  <PCAT_CMPD_ID> (434)
WAY-304501

>  <CNC_ID> (434)
359395681

>  <transfer_container_id> (434)
PTN000000072

>  <COMPOUND_NUMBER> (434)
WAY-304501

>  <BAR_CODE_NO> (434)
3907601

>  <LOCATION_CODE> (434)
PTNCS

>  <AMOUNT_CURRENT> (434)
33.4

$$$$
WAY-304505-A
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
   -0.0789    0.9129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  5  1  0  0  0  0
 10  4  1  0  0  0  0
 11 14  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 23  1  0  0  0  0
 16 12  2  0  0  0  0
 17 13  1  0  0  0  0
 18 17  2  0  0  0  0
 19  7  1  0  0  0  0
 20  8  1  0  0  0  0
 21 11  1  0  0  0  0
 22 11  1  0  0  0  0
 23 22  1  0  0  0  0
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 25 12  1  0  0  0  0
 26 17  1  0  0  0  0
 27 20  2  0  0  0  0
 28 19  2  0  0  0  0
  7  8  2  0  0  0  0
  6  5  2  0  0  0  0
 27 28  1  0  0  0  0
 15 24  1  0  0  0  0
 18 16  1  0  0  0  0
M  END
>  <Mol_ID> (435)
435

>  <Formula> (435)
C23H26N4O

>  <MolWeight> (435)
374.47874

>  <PCAT_CMPD_ID> (435)
WAY-304505-A

>  <CNC_ID> (435)
359395685

>  <transfer_container_id> (435)
PTN000000072

>  <COMPOUND_NUMBER> (435)
WAY-304505-A

>  <BAR_CODE_NO> (435)
3907605

>  <LOCATION_CODE> (435)
PTNCS

>  <AMOUNT_CURRENT> (435)
33.7

$$$$
WAY-304513
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  2  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
  5  8  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (436)
436

>  <Formula> (436)
C16H20N2O2S3

>  <MolWeight> (436)
368.5372

>  <PCAT_CMPD_ID> (436)
WAY-304513

>  <CNC_ID> (436)
359395693

>  <transfer_container_id> (436)
PTN000000072

>  <COMPOUND_NUMBER> (436)
WAY-304513

>  <BAR_CODE_NO> (436)
3907615

>  <LOCATION_CODE> (436)
PTNCS

>  <AMOUNT_CURRENT> (436)
33.1

$$$$
WAY-304529
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
 13  2  2  0  0  0  0
 14  3  2  0  0  0  0
 15  8  1  0  0  0  0
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 22 21  2  0  0  0  0
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 25 24  1  0  0  0  0
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 11 12  2  0  0  0  0
 23 19  2  0  0  0  0
M  END
>  <Mol_ID> (437)
437

>  <Formula> (437)
C18H19ClN2O4

>  <MolWeight> (437)
362.80746

>  <PCAT_CMPD_ID> (437)
WAY-304529

>  <CNC_ID> (437)
359395709

>  <transfer_container_id> (437)
PTN000000072

>  <COMPOUND_NUMBER> (437)
WAY-304529

>  <BAR_CODE_NO> (437)
3907633

>  <LOCATION_CODE> (437)
PTNCS

>  <AMOUNT_CURRENT> (437)
33.5

$$$$
WAY-304537
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
 12 14  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (438)
438

>  <Formula> (438)
C14H8FNO2S2

>  <MolWeight> (438)
305.3472232

>  <PCAT_CMPD_ID> (438)
WAY-304537

>  <CNC_ID> (438)
359395717

>  <transfer_container_id> (438)
PTN000000072

>  <COMPOUND_NUMBER> (438)
WAY-304537

>  <BAR_CODE_NO> (438)
3907642

>  <LOCATION_CODE> (438)
PTNCS

>  <AMOUNT_CURRENT> (438)
33.3

$$$$
WAY-304540
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  5  7  1  0  0  0  0
 14 16  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (439)
439

>  <Formula> (439)
C15H20N2OS

>  <MolWeight> (439)
276.3971

>  <PCAT_CMPD_ID> (439)
WAY-304540

>  <CNC_ID> (439)
359395720

>  <transfer_container_id> (439)
PTN000000072

>  <COMPOUND_NUMBER> (439)
WAY-304540

>  <BAR_CODE_NO> (439)
3907646

>  <LOCATION_CODE> (439)
PTNCS

>  <AMOUNT_CURRENT> (439)
33.3

$$$$
WAY-304544
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    0.1655    0.1103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (440)
440

>  <Formula> (440)
C15H16N2O3

>  <MolWeight> (440)
272.29914

>  <PCAT_CMPD_ID> (440)
WAY-304544

>  <CNC_ID> (440)
359395724

>  <transfer_container_id> (440)
PTN000000072

>  <COMPOUND_NUMBER> (440)
WAY-304544

>  <BAR_CODE_NO> (440)
3907651

>  <LOCATION_CODE> (440)
PTNCS

>  <AMOUNT_CURRENT> (440)
33.2

$$$$
WAY-304555
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (441)
441

>  <Formula> (441)
C25H24ClN3O2S2

>  <MolWeight> (441)
498.05996

>  <PCAT_CMPD_ID> (441)
WAY-304555

>  <CNC_ID> (441)
359395735

>  <transfer_container_id> (441)
PTN000000072

>  <COMPOUND_NUMBER> (441)
WAY-304555

>  <BAR_CODE_NO> (441)
3907666

>  <LOCATION_CODE> (441)
PTNCS

>  <AMOUNT_CURRENT> (441)
33.3

$$$$
WAY-304579
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
  9 11  1  0  0  0  0
 13 16  1  0  0  0  0
 23 26  1  0  0  0  0
M  END
>  <Mol_ID> (442)
442

>  <Formula> (442)
C19H18N2O3S2

>  <MolWeight> (442)
386.48782

>  <PCAT_CMPD_ID> (442)
WAY-304579

>  <CNC_ID> (442)
359395759

>  <transfer_container_id> (442)
PTN000000072

>  <COMPOUND_NUMBER> (442)
WAY-304579

>  <BAR_CODE_NO> (442)
3907691

>  <LOCATION_CODE> (442)
PTNCS

>  <AMOUNT_CURRENT> (442)
33.6

$$$$
WAY-304606
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 21 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (443)
443

>  <Formula> (443)
C18H17N3O3

>  <MolWeight> (443)
323.34588

>  <PCAT_CMPD_ID> (443)
WAY-304606

>  <CNC_ID> (443)
359395786

>  <transfer_container_id> (443)
PTN000000072

>  <COMPOUND_NUMBER> (443)
WAY-304606

>  <BAR_CODE_NO> (443)
3907724

>  <LOCATION_CODE> (443)
PTNCS

>  <AMOUNT_CURRENT> (443)
33.8

$$$$
WAY-304611
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   -1.5686    0.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0099   -0.0208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0694   -0.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
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 10 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 17 22  2  0  0  0  0
 18 23  1  0  0  0  0
 21 24  2  0  0  0  0
 22 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 28 30  1  0  0  0  0
  9 10  1  0  0  0  0
 14 18  1  0  0  0  0
 19 20  2  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (444)
444

>  <Formula> (444)
C25H24N2O3

>  <MolWeight> (444)
400.46966

>  <PCAT_CMPD_ID> (444)
WAY-304611

>  <CNC_ID> (444)
359395791

>  <transfer_container_id> (444)
PTN000000072

>  <COMPOUND_NUMBER> (444)
WAY-304611

>  <BAR_CODE_NO> (444)
3907729

>  <LOCATION_CODE> (444)
PTNCS

>  <AMOUNT_CURRENT> (444)
33.9

$$$$
WAY-304615
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    1.0379   -0.8759    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
  6  7  1  0  0  0  0
  8 10  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (445)
445

>  <Formula> (445)
C17H22FNO

>  <MolWeight> (445)
275.3610832

>  <PCAT_CMPD_ID> (445)
WAY-304615

>  <CNC_ID> (445)
359395795

>  <transfer_container_id> (445)
PTN000000072

>  <COMPOUND_NUMBER> (445)
WAY-304615

>  <BAR_CODE_NO> (445)
3907733

>  <LOCATION_CODE> (445)
PTNCS

>  <AMOUNT_CURRENT> (445)
33.2

$$$$
WAY-304616
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
    1.7828   -0.1483    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 15 16  1  0  0  0  0
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 16 18  1  0  0  0  0
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 17 20  1  0  0  0  0
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 18 22  2  0  0  0  0
 20 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  5  7  1  0  0  0  0
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 18 20  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (446)
446

>  <Formula> (446)
C20H24N2O3

>  <MolWeight> (446)
340.41616

>  <PCAT_CMPD_ID> (446)
WAY-304616

>  <CNC_ID> (446)
359395796

>  <transfer_container_id> (446)
PTN000000072

>  <COMPOUND_NUMBER> (446)
WAY-304616

>  <BAR_CODE_NO> (446)
3907734

>  <LOCATION_CODE> (446)
PTNCS

>  <AMOUNT_CURRENT> (446)
33.2

$$$$
WAY-304617
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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   -3.8276    1.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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 13 17  1  0  0  0  0
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 17 19  1  0  0  0  0
 17 20  2  0  0  0  0
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 18 22  2  0  0  0  0
 19 23  2  0  0  0  0
 21 24  2  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
  5  7  1  0  0  0  0
 10 11  1  0  0  0  0
 19 21  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (447)
447

>  <Formula> (447)
C21H26N2O3

>  <MolWeight> (447)
354.44274

>  <PCAT_CMPD_ID> (447)
WAY-304617

>  <CNC_ID> (447)
359395797

>  <transfer_container_id> (447)
PTN000000072

>  <COMPOUND_NUMBER> (447)
WAY-304617

>  <BAR_CODE_NO> (447)
3907735

>  <LOCATION_CODE> (447)
PTNCS

>  <AMOUNT_CURRENT> (447)
33.6

$$$$
WAY-304626
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    0.8310   -0.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
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  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
  8 10  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (448)
448

>  <Formula> (448)
C12H13N3OS

>  <MolWeight> (448)
247.31612

>  <PCAT_CMPD_ID> (448)
WAY-304626

>  <CNC_ID> (448)
359395806

>  <transfer_container_id> (448)
PTN000000072

>  <COMPOUND_NUMBER> (448)
WAY-304626

>  <BAR_CODE_NO> (448)
3907744

>  <LOCATION_CODE> (448)
PTNCS

>  <AMOUNT_CURRENT> (448)
33.1

$$$$
WAY-304629
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.5517    0.9655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6379    1.7793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  8 12  2  0  0  0  0
 10 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  2  0  0  0  0
 16 21  1  0  0  0  0
 18 22  2  0  0  0  0
 19 23  1  0  0  0  0
 22 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (449)
449

>  <Formula> (449)
C17H17N3O3S

>  <MolWeight> (449)
343.40018

>  <PCAT_CMPD_ID> (449)
WAY-304629

>  <CNC_ID> (449)
359395809

>  <transfer_container_id> (449)
PTN000000072

>  <COMPOUND_NUMBER> (449)
WAY-304629

>  <BAR_CODE_NO> (449)
3907748

>  <LOCATION_CODE> (449)
PTNCS

>  <AMOUNT_CURRENT> (449)
33.2

$$$$
WAY-304637
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.8964   -0.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0722    0.1100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8964   -1.0175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0722   -1.2762    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6446   -1.4486    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4032   -0.1486    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4032   -1.0175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  2  0  0  0  0
 11 16  1  0  0  0  0
 13 17  2  0  0  0  0
 15 18  1  0  0  0  0
 16 19  2  0  0  0  0
 18 20  2  0  0  0  0
 18 21  1  0  0  0  0
  6  7  2  0  0  0  0
  9 13  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (450)
450

>  <Formula> (450)
C14H13BrN4O2

>  <MolWeight> (450)
349.18262

>  <PCAT_CMPD_ID> (450)
WAY-304637

>  <CNC_ID> (450)
359395817

>  <transfer_container_id> (450)
PTN000000072

>  <COMPOUND_NUMBER> (450)
WAY-304637

>  <BAR_CODE_NO> (450)
3907760

>  <LOCATION_CODE> (450)
PTNCS

>  <AMOUNT_CURRENT> (450)
33.1

$$$$
WAY-304669
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.0034    0.9338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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 11 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7  8  2  0  0  0  0
  9 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (451)
451

>  <Formula> (451)
C14H15ClN4OS

>  <MolWeight> (451)
322.8131

>  <PCAT_CMPD_ID> (451)
WAY-304669

>  <CNC_ID> (451)
359395849

>  <transfer_container_id> (451)
PTN000000072

>  <COMPOUND_NUMBER> (451)
WAY-304669

>  <BAR_CODE_NO> (451)
3907796

>  <LOCATION_CODE> (451)
PTNCS

>  <AMOUNT_CURRENT> (451)
33

$$$$
WAY-304671
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
    2.2522   -0.7102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14 15  2  0  0  0  0
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 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  2  0  0  0  0
  8 10  1  0  0  0  0
 17 18  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (452)
452

>  <Formula> (452)
C16H9ClN2OS2

>  <MolWeight> (452)
344.83846

>  <PCAT_CMPD_ID> (452)
WAY-304671

>  <CNC_ID> (452)
359395851

>  <transfer_container_id> (452)
PTN000000072

>  <COMPOUND_NUMBER> (452)
WAY-304671

>  <BAR_CODE_NO> (452)
3907798

>  <LOCATION_CODE> (452)
PTNCS

>  <AMOUNT_CURRENT> (452)
33.7

$$$$
WAY-304680
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 16 19  1  0  0  0  0
M  END
>  <Mol_ID> (453)
453

>  <Formula> (453)
C13H16N2O4

>  <MolWeight> (453)
264.27714

>  <PCAT_CMPD_ID> (453)
WAY-304680

>  <CNC_ID> (453)
359395860

>  <transfer_container_id> (453)
PTN000000072

>  <COMPOUND_NUMBER> (453)
WAY-304680

>  <BAR_CODE_NO> (453)
3907808

>  <LOCATION_CODE> (453)
PTNCS

>  <AMOUNT_CURRENT> (453)
33.2

$$$$
WAY-304684
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (454)
454

>  <Formula> (454)
C16H24N2O4S

>  <MolWeight> (454)
340.43776

>  <PCAT_CMPD_ID> (454)
WAY-304684

>  <CNC_ID> (454)
359395864

>  <transfer_container_id> (454)
PTN000000072

>  <COMPOUND_NUMBER> (454)
WAY-304684

>  <BAR_CODE_NO> (454)
3907812

>  <LOCATION_CODE> (454)
PTNCS

>  <AMOUNT_CURRENT> (454)
33.3

$$$$
WAY-304686
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (455)
455

>  <Formula> (455)
C13H15Cl2NO

>  <MolWeight> (455)
272.1703

>  <PCAT_CMPD_ID> (455)
WAY-304686

>  <CNC_ID> (455)
359395866

>  <transfer_container_id> (455)
PTN000000072

>  <COMPOUND_NUMBER> (455)
WAY-304686

>  <BAR_CODE_NO> (455)
3907816

>  <LOCATION_CODE> (455)
PTNCS

>  <AMOUNT_CURRENT> (455)
33.2

$$$$
WAY-304687
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (456)
456

>  <Formula> (456)
C16H19N3O4S

>  <MolWeight> (456)
349.40476

>  <PCAT_CMPD_ID> (456)
WAY-304687

>  <CNC_ID> (456)
359395867

>  <transfer_container_id> (456)
PTN000000072

>  <COMPOUND_NUMBER> (456)
WAY-304687

>  <BAR_CODE_NO> (456)
3907817

>  <LOCATION_CODE> (456)
PTNCS

>  <AMOUNT_CURRENT> (456)
33.8

$$$$
WAY-304688
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (457)
457

>  <Formula> (457)
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>  <MolWeight> (457)
226.2274

>  <PCAT_CMPD_ID> (457)
WAY-304688

>  <CNC_ID> (457)
359395868

>  <transfer_container_id> (457)
PTN000000072

>  <COMPOUND_NUMBER> (457)
WAY-304688

>  <BAR_CODE_NO> (457)
3907818

>  <LOCATION_CODE> (457)
PTNCS

>  <AMOUNT_CURRENT> (457)
33.8

$$$$
WAY-304699
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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    3.1723   -1.7415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6723   -2.2898    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 26 28  2  0  0  0  0
 28 29  1  0  0  0  0
  6  7  2  0  0  0  0
  9 11  1  0  0  0  0
 21 22  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (458)
458

>  <Formula> (458)
C19H21FN6O3

>  <MolWeight> (458)
400.4068432

>  <PCAT_CMPD_ID> (458)
WAY-304699

>  <CNC_ID> (458)
359395879

>  <transfer_container_id> (458)
PTN000000072

>  <COMPOUND_NUMBER> (458)
WAY-304699

>  <BAR_CODE_NO> (458)
3907831

>  <LOCATION_CODE> (458)
PTNCS

>  <AMOUNT_CURRENT> (458)
33.2

$$$$
WAY-304708
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   -2.9759    0.9069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0552    1.4448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.8552    0.9069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1552   -0.7345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4862   -0.7138    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (459)
459

>  <Formula> (459)
C18H15N3O3

>  <MolWeight> (459)
321.33

>  <PCAT_CMPD_ID> (459)
WAY-304708

>  <CNC_ID> (459)
359395888

>  <transfer_container_id> (459)
PTN000000072

>  <COMPOUND_NUMBER> (459)
WAY-304708

>  <BAR_CODE_NO> (459)
3907841

>  <LOCATION_CODE> (459)
PTNCS

>  <AMOUNT_CURRENT> (459)
33.9

$$$$
WAY-304715
csChFnd80/10111816222D

 18 21  0  0  0  0  0  0  0  0999 V2000
    0.9344    0.7144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2931    1.4695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9344   -0.7063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5000    0.7144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5000   -0.7063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.9518   -0.7063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  2  0  0  0  0
 16 18  2  0  0  0  0
  6  9  1  0  0  0  0
  7 11  1  0  0  0  0
 10 14  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (460)
460

>  <Formula> (460)
C14H6ClNO2

>  <MolWeight> (460)
255.65594

>  <PCAT_CMPD_ID> (460)
WAY-304715

>  <CNC_ID> (460)
359395895

>  <transfer_container_id> (460)
PTN000000072

>  <COMPOUND_NUMBER> (460)
WAY-304715

>  <BAR_CODE_NO> (460)
3907850

>  <LOCATION_CODE> (460)
PTNCS

>  <AMOUNT_CURRENT> (460)
33.4

$$$$
WAY-304722
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    0.5828    0.2969    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5828   -0.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3103    0.7072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2034    0.5313    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  5 10  1  0  0  0  0
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 11 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 19 22  2  0  0  0  0
 20 23  1  0  0  0  0
 21 24  2  0  0  0  0
 21 25  1  0  0  0  0
 22 26  1  0  0  0  0
 24 27  1  0  0  0  0
 25 28  2  0  0  0  0
 27 29  2  0  0  0  0
 29 30  1  0  0  0  0
  5  9  1  0  0  0  0
  7 11  1  0  0  0  0
 23 26  2  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (461)
461

>  <Formula> (461)
C19H10BrClF3N5O

>  <MolWeight> (461)
496.6678096

>  <PCAT_CMPD_ID> (461)
WAY-304722

>  <CNC_ID> (461)
359395902

>  <transfer_container_id> (461)
PTN000000072

>  <COMPOUND_NUMBER> (461)
WAY-304722

>  <BAR_CODE_NO> (461)
3907860

>  <LOCATION_CODE> (461)
PTNCS

>  <AMOUNT_CURRENT> (461)
33.5

$$$$
WAY-304727
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    1.8379   -0.1383    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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 27 29  1  0  0  0  0
  7  9  2  0  0  0  0
 12 15  2  0  0  0  0
 22 23  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (462)
462

>  <Formula> (462)
C22H20N4O3

>  <MolWeight> (462)
388.4192

>  <PCAT_CMPD_ID> (462)
WAY-304727

>  <CNC_ID> (462)
359395907

>  <transfer_container_id> (462)
PTN000000072

>  <COMPOUND_NUMBER> (462)
WAY-304727

>  <BAR_CODE_NO> (462)
3907867

>  <LOCATION_CODE> (462)
PTNCS

>  <AMOUNT_CURRENT> (462)
33.9

$$$$
WAY-304733
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 15  2  0  0  0  0
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  7 13  1  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (463)
463

>  <Formula> (463)
C15H18N2O3

>  <MolWeight> (463)
274.31502

>  <PCAT_CMPD_ID> (463)
WAY-304733

>  <CNC_ID> (463)
359395913

>  <transfer_container_id> (463)
PTN000000072

>  <COMPOUND_NUMBER> (463)
WAY-304733

>  <BAR_CODE_NO> (463)
3907873

>  <LOCATION_CODE> (463)
PTNCS

>  <AMOUNT_CURRENT> (463)
33.8

$$$$
WAY-304738
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 16  2  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 14 20  2  0  0  0  0
 15 21  2  0  0  0  0
 16 22  1  0  0  0  0
 17 23  2  0  0  0  0
 18 24  1  0  0  0  0
 19 25  1  0  0  0  0
 22 26  2  0  0  0  0
  7  9  2  0  0  0  0
 20 21  1  0  0  0  0
 23 26  1  0  0  0  0
M  END
>  <Mol_ID> (464)
464

>  <Formula> (464)
C21H22N2O3

>  <MolWeight> (464)
350.41098

>  <PCAT_CMPD_ID> (464)
WAY-304738

>  <CNC_ID> (464)
359395918

>  <transfer_container_id> (464)
PTN000000072

>  <COMPOUND_NUMBER> (464)
WAY-304738

>  <BAR_CODE_NO> (464)
3907878

>  <LOCATION_CODE> (464)
PTNCS

>  <AMOUNT_CURRENT> (464)
33.6

$$$$
WAY-304742
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 25 26  1  0  0  0  0
  5  7  1  0  0  0  0
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 11 14  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (465)
465

>  <Formula> (465)
C18H14ClN5OS

>  <MolWeight> (465)
383.85466

>  <PCAT_CMPD_ID> (465)
WAY-304742

>  <CNC_ID> (465)
359395922

>  <transfer_container_id> (465)
PTN000000072

>  <COMPOUND_NUMBER> (465)
WAY-304742

>  <BAR_CODE_NO> (465)
3907885

>  <LOCATION_CODE> (465)
PTNCS

>  <AMOUNT_CURRENT> (465)
33

$$$$
WAY-304746
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 24 27  1  0  0  0  0
 26 28  2  0  0  0  0
M  END
>  <Mol_ID> (466)
466

>  <Formula> (466)
C19H16ClF3N4O2

>  <MolWeight> (466)
424.8041496

>  <PCAT_CMPD_ID> (466)
WAY-304746

>  <CNC_ID> (466)
359395926

>  <transfer_container_id> (466)
PTN000000072

>  <COMPOUND_NUMBER> (466)
WAY-304746

>  <BAR_CODE_NO> (466)
3907890

>  <LOCATION_CODE> (466)
PTNCS

>  <AMOUNT_CURRENT> (466)
33.1

$$$$
WAY-304781
csChFnd80/10111816222D

 15 17  0  0  0  0  0  0  0  0999 V2000
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 11 15  2  0  0  0  0
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M  END
>  <Mol_ID> (467)
467

>  <Formula> (467)
C10H11NO4

>  <MolWeight> (467)
209.19864

>  <PCAT_CMPD_ID> (467)
WAY-304781

>  <CNC_ID> (467)
359395960

>  <transfer_container_id> (467)
PTN000000072

>  <COMPOUND_NUMBER> (467)
WAY-304781

>  <BAR_CODE_NO> (467)
3907932

>  <LOCATION_CODE> (467)
PTNCS

>  <AMOUNT_CURRENT> (467)
33.3

$$$$
WAY-304849
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 20  1  0  0  0  0
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 22 24  1  0  0  0  0
  7 11  1  0  0  0  0
 18 20  2  0  0  0  0
M  END
>  <Mol_ID> (468)
468

>  <Formula> (468)
C18H23NO4S

>  <MolWeight> (468)
349.44452

>  <PCAT_CMPD_ID> (468)
WAY-304849

>  <CNC_ID> (468)
359396028

>  <transfer_container_id> (468)
PTN000000072

>  <COMPOUND_NUMBER> (468)
WAY-304849

>  <BAR_CODE_NO> (468)
3908006

>  <LOCATION_CODE> (468)
PTNCS

>  <AMOUNT_CURRENT> (468)
33.4

$$$$
WAY-304910
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
  6  8  1  0  0  0  0
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (469)
469

>  <Formula> (469)
C15H14N2O5S

>  <MolWeight> (469)
334.34706

>  <PCAT_CMPD_ID> (469)
WAY-304910

>  <CNC_ID> (469)
359396088

>  <transfer_container_id> (469)
PTN000000072

>  <COMPOUND_NUMBER> (469)
WAY-304910

>  <BAR_CODE_NO> (469)
3908077

>  <LOCATION_CODE> (469)
PTNCS

>  <AMOUNT_CURRENT> (469)
33.4

$$$$
WAY-304992
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 16 20  2  0  0  0  0
  5  8  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (470)
470

>  <Formula> (470)
C13H12FN3O3

>  <MolWeight> (470)
277.2510832

>  <PCAT_CMPD_ID> (470)
WAY-304992

>  <CNC_ID> (470)
359396169

>  <transfer_container_id> (470)
PTN000000072

>  <COMPOUND_NUMBER> (470)
WAY-304992

>  <BAR_CODE_NO> (470)
3908175

>  <LOCATION_CODE> (470)
PTNCS

>  <AMOUNT_CURRENT> (470)
33.2

$$$$
WAY-305000
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.3210    1.1033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 13  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (471)
471

>  <Formula> (471)
C16H16N4S

>  <MolWeight> (471)
296.39004

>  <PCAT_CMPD_ID> (471)
WAY-305000

>  <CNC_ID> (471)
359396177

>  <transfer_container_id> (471)
PTN000000072

>  <COMPOUND_NUMBER> (471)
WAY-305000

>  <BAR_CODE_NO> (471)
3908185

>  <LOCATION_CODE> (471)
PTNCS

>  <AMOUNT_CURRENT> (471)
33.8

$$$$
WAY-305025
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  7  2  0  0  0  0
 12  9  2  0  0  0  0
 13  3  1  0  0  0  0
 14  9  1  0  0  0  0
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  3  4  2  0  0  0  0
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M  END
>  <Mol_ID> (472)
472

>  <Formula> (472)
C9H8N2O3S

>  <MolWeight> (472)
224.23642

>  <PCAT_CMPD_ID> (472)
WAY-305025

>  <CNC_ID> (472)
359396202

>  <transfer_container_id> (472)
PTN000000072

>  <COMPOUND_NUMBER> (472)
WAY-305025

>  <BAR_CODE_NO> (472)
3908215

>  <LOCATION_CODE> (472)
PTNCS

>  <AMOUNT_CURRENT> (472)
33.8

$$$$
WAY-305032
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (473)
473

>  <Formula> (473)
C15H17NO5

>  <MolWeight> (473)
291.29918

>  <PCAT_CMPD_ID> (473)
WAY-305032

>  <CNC_ID> (473)
359396209

>  <transfer_container_id> (473)
PTN000000072

>  <COMPOUND_NUMBER> (473)
WAY-305032

>  <BAR_CODE_NO> (473)
3908223

>  <LOCATION_CODE> (473)
PTNCS

>  <AMOUNT_CURRENT> (473)
33.1

$$$$
WAY-305045
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 18 21  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (474)
474

>  <Formula> (474)
C18H18N2O3S

>  <MolWeight> (474)
342.41212

>  <PCAT_CMPD_ID> (474)
WAY-305045

>  <CNC_ID> (474)
359396222

>  <transfer_container_id> (474)
PTN000000072

>  <COMPOUND_NUMBER> (474)
WAY-305045

>  <BAR_CODE_NO> (474)
3908244

>  <LOCATION_CODE> (474)
PTNCS

>  <AMOUNT_CURRENT> (474)
33.4

$$$$
WAY-305061
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 23 27  2  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (475)
475

>  <Formula> (475)
C25H23N3O3S

>  <MolWeight> (475)
445.53342

>  <PCAT_CMPD_ID> (475)
WAY-305061

>  <CNC_ID> (475)
359396238

>  <transfer_container_id> (475)
PTN000000072

>  <COMPOUND_NUMBER> (475)
WAY-305061

>  <BAR_CODE_NO> (475)
3908264

>  <LOCATION_CODE> (475)
PTNCS

>  <AMOUNT_CURRENT> (475)
33.8

$$$$
WAY-305191
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (476)
476

>  <Formula> (476)
C18H17NO2S2

>  <MolWeight> (476)
343.46308

>  <PCAT_CMPD_ID> (476)
WAY-305191

>  <CNC_ID> (476)
359396367

>  <transfer_container_id> (476)
PTN000000072

>  <COMPOUND_NUMBER> (476)
WAY-305191

>  <BAR_CODE_NO> (476)
3908421

>  <LOCATION_CODE> (476)
PTNCS

>  <AMOUNT_CURRENT> (476)
33.5

$$$$
WAY-305201
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  8  9  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (477)
477

>  <Formula> (477)
C12H14N2O2S2

>  <MolWeight> (477)
282.38176

>  <PCAT_CMPD_ID> (477)
WAY-305201

>  <CNC_ID> (477)
359396377

>  <transfer_container_id> (477)
PTN000000072

>  <COMPOUND_NUMBER> (477)
WAY-305201

>  <BAR_CODE_NO> (477)
3908434

>  <LOCATION_CODE> (477)
PTNCS

>  <AMOUNT_CURRENT> (477)
33.5

$$$$
WAY-305205
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 13 16  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (478)
478

>  <Formula> (478)
C17H14FN3OS

>  <MolWeight> (478)
327.3759632

>  <PCAT_CMPD_ID> (478)
WAY-305205

>  <CNC_ID> (478)
359396381

>  <transfer_container_id> (478)
PTN000000072

>  <COMPOUND_NUMBER> (478)
WAY-305205

>  <BAR_CODE_NO> (478)
3908439

>  <LOCATION_CODE> (478)
PTNCS

>  <AMOUNT_CURRENT> (478)
30.4

$$$$
WAY-305238
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12 16  1  0  0  0  0
 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (479)
479

>  <Formula> (479)
C18H19N3O4S

>  <MolWeight> (479)
373.42616

>  <PCAT_CMPD_ID> (479)
WAY-305238

>  <CNC_ID> (479)
359396414

>  <transfer_container_id> (479)
PTN000000072

>  <COMPOUND_NUMBER> (479)
WAY-305238

>  <BAR_CODE_NO> (479)
3908476

>  <LOCATION_CODE> (479)
PTNCS

>  <AMOUNT_CURRENT> (479)
33.5

$$$$
WAY-305245
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 16 19  2  0  0  0  0
 17 20  2  0  0  0  0
  7  8  1  0  0  0  0
 11 13  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (480)
480

>  <Formula> (480)
C16H13ClN2O

>  <MolWeight> (480)
284.74022

>  <PCAT_CMPD_ID> (480)
WAY-305245

>  <CNC_ID> (480)
359396421

>  <transfer_container_id> (480)
PTN000000072

>  <COMPOUND_NUMBER> (480)
WAY-305245

>  <BAR_CODE_NO> (480)
3908484

>  <LOCATION_CODE> (480)
PTNCS

>  <AMOUNT_CURRENT> (480)
33.2

$$$$
WAY-305251
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 20 24  1  0  0  0  0
  7  9  2  0  0  0  0
 11 13  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (481)
481

>  <Formula> (481)
C18H14N2O3S

>  <MolWeight> (481)
338.38036

>  <PCAT_CMPD_ID> (481)
WAY-305251

>  <CNC_ID> (481)
359396427

>  <transfer_container_id> (481)
PTN000000072

>  <COMPOUND_NUMBER> (481)
WAY-305251

>  <BAR_CODE_NO> (481)
3908490

>  <LOCATION_CODE> (481)
PTNCS

>  <AMOUNT_CURRENT> (481)
33.3

$$$$
WAY-305271
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 14 16  1  0  0  0  0
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M  END
>  <Mol_ID> (482)
482

>  <Formula> (482)
C18H22N2O5S

>  <MolWeight> (482)
378.44268

>  <PCAT_CMPD_ID> (482)
WAY-305271

>  <CNC_ID> (482)
359396447

>  <transfer_container_id> (482)
PTN000000072

>  <COMPOUND_NUMBER> (482)
WAY-305271

>  <BAR_CODE_NO> (482)
3908518

>  <LOCATION_CODE> (482)
PTNCS

>  <AMOUNT_CURRENT> (482)
33.4

$$$$
WAY-305383
csChFnd80/10111816222D

 33 38  0  0  0  0  0  0  0  0999 V2000
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  4  9  1  0  0  0  0
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  5 11  2  0  0  0  0
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 11 16  1  0  0  0  0
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 18 22  1  0  0  0  0
 19 23  2  0  0  0  0
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 20 25  1  0  0  0  0
 21 26  1  0  0  0  0
 23 27  1  0  0  0  0
 24 28  2  0  0  0  0
 26 29  1  0  0  0  0
 27 30  2  0  0  0  0
 27 31  1  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
  9 14  1  0  0  0  0
 13 15  1  0  0  0  0
 17 21  1  0  0  0  0
 22 25  2  0  0  0  0
 28 30  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
>  <Mol_ID> (483)
483

>  <Formula> (483)
C27H24N2O3S

>  <MolWeight> (483)
456.55606

>  <PCAT_CMPD_ID> (483)
WAY-305383

>  <CNC_ID> (483)
359396559

>  <transfer_container_id> (483)
PTN000000072

>  <COMPOUND_NUMBER> (483)
WAY-305383

>  <BAR_CODE_NO> (483)
3908656

>  <LOCATION_CODE> (483)
PTNCS

>  <AMOUNT_CURRENT> (483)
33.1

$$$$
WAY-383469
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
    5.6667   -5.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  4  1  0  0  0  0
  8  4  1  0  0  0  0
  9 20  2  0  0  0  0
 10  7  1  0  0  0  0
 11  2  1  0  0  0  0
 12 16  2  0  0  0  0
 13 12  1  0  0  0  0
 14 10  1  0  0  0  0
 15 10  2  0  0  0  0
 16 15  1  0  0  0  0
 17 14  2  0  0  0  0
 18  5  1  0  0  0  0
 19  6  1  0  0  0  0
 20 23  1  0  0  0  0
 21 22  2  0  0  0  0
 22  8  1  0  0  0  0
 23  8  2  0  0  0  0
 24 18  2  0  0  0  0
 25 24  1  0  0  0  0
  6  3  1  0  0  0  0
 25 19  2  0  0  0  0
  9 21  1  0  0  0  0
 12 17  1  0  0  0  0
M  END
>  <Mol_ID> (484)
484

>  <Formula> (484)
C21H18FN3

>  <MolWeight> (484)
331.3861232

>  <PCAT_CMPD_ID> (484)
WAY-383469

>  <CNC_ID> (484)
359399532

>  <transfer_container_id> (484)
PTN000000072

>  <COMPOUND_NUMBER> (484)
WAY-383469

>  <BAR_CODE_NO> (484)
2546041

>  <LOCATION_CODE> (484)
PTNCS

>  <AMOUNT_CURRENT> (484)
24.1

$$$$
WAY-383564
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  2  0  0  0  0
  8  2  1  0  0  0  0
  9  8  1  0  0  0  0
 10  7  1  0  0  0  0
 11  5  2  0  0  0  0
 12  4  1  0  0  0  0
 13  3  1  0  0  0  0
 14  8  1  0  0  0  0
 15  9  1  0  0  0  0
 16 10  1  0  0  0  0
 17 12  2  0  0  0  0
 18 12  1  0  0  0  0
 19 15  2  0  0  0  0
 20 16  2  0  0  0  0
 21 18  2  0  0  0  0
 22 17  1  0  0  0  0
 23 21  1  0  0  0  0
  4  5  1  0  0  0  0
 10  9  2  0  0  0  0
 20 19  1  0  0  0  0
 23 22  2  0  0  0  0
M  END
>  <Mol_ID> (485)
485

>  <Formula> (485)
C17H14N4S2

>  <MolWeight> (485)
338.44986

>  <PCAT_CMPD_ID> (485)
WAY-383564

>  <CNC_ID> (485)
359399634

>  <transfer_container_id> (485)
PTN000000072

>  <COMPOUND_NUMBER> (485)
WAY-383564

>  <BAR_CODE_NO> (485)
2546531

>  <LOCATION_CODE> (485)
PTNCS

>  <AMOUNT_CURRENT> (485)
32.6

$$$$
WAY-383566
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
    1.1542    0.7708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  7  3  0  0  0  0
  9  5  1  0  0  0  0
 10 14  1  0  0  0  0
 11  6  1  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15  9  1  0  0  0  0
 16  9  1  0  0  0  0
  4  5  2  0  0  0  0
 10 13  1  0  0  0  0
M  END
>  <Mol_ID> (486)
486

>  <Formula> (486)
C11H15N3O2

>  <MolWeight> (486)
221.2557

>  <PCAT_CMPD_ID> (486)
WAY-383566

>  <CNC_ID> (486)
359399636

>  <transfer_container_id> (486)
PTN000000072

>  <COMPOUND_NUMBER> (486)
WAY-383566

>  <BAR_CODE_NO> (486)
2546509

>  <LOCATION_CODE> (486)
PTNCS

>  <AMOUNT_CURRENT> (486)
32.3

$$$$
WAY-383587
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    4.1417    2.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000    0.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2792   -1.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  3  2  0  0  0  0
 11  5  2  0  0  0  0
 12  4  1  0  0  0  0
 13  4  2  0  0  0  0
 14  6  1  0  0  0  0
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 16  7  1  0  0  0  0
 17 19  2  0  0  0  0
 18 12  2  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 16  2  0  0  0  0
 24 16  1  0  0  0  0
 25  1  1  0  0  0  0
 26  1  1  0  0  0  0
 27  5  1  0  0  0  0
 28 25  1  0  0  0  0
 29 26  1  0  0  0  0
 29 28  1  0  0  0  0
 17 18  1  0  0  0  0
 15 21  2  0  0  0  0
M  END
>  <Mol_ID> (487)
487

>  <Formula> (487)
C22H23ClN2O4

>  <MolWeight> (487)
414.88202

>  <PCAT_CMPD_ID> (487)
WAY-383587

>  <CNC_ID> (487)
359399657

>  <transfer_container_id> (487)
PTN000000072

>  <COMPOUND_NUMBER> (487)
WAY-383587

>  <BAR_CODE_NO> (487)
2545662

>  <LOCATION_CODE> (487)
PTNCS

>  <AMOUNT_CURRENT> (487)
32.3

$$$$
WAY-383651
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  4  2  0  0  0  0
 12  4  1  0  0  0  0
 13  3  1  0  0  0  0
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 24  6  2  0  0  0  0
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 18 26  1  0  0  0  0
M  END
>  <Mol_ID> (488)
488

>  <Formula> (488)
C22H22N2O4S

>  <MolWeight> (488)
410.48608

>  <PCAT_CMPD_ID> (488)
WAY-383651

>  <CNC_ID> (488)
359399718

>  <transfer_container_id> (488)
PTN000000072

>  <COMPOUND_NUMBER> (488)
WAY-383651

>  <BAR_CODE_NO> (488)
2545889

>  <LOCATION_CODE> (488)
PTNCS

>  <AMOUNT_CURRENT> (488)
32.3

$$$$
WAY-383665
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
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 14 15  2  0  0  0  0
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 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (489)
489

>  <Formula> (489)
C14H11ClN4O

>  <MolWeight> (489)
286.71634

>  <PCAT_CMPD_ID> (489)
WAY-383665

>  <CNC_ID> (489)
359399725

>  <transfer_container_id> (489)
PTN000000072

>  <COMPOUND_NUMBER> (489)
WAY-383665

>  <BAR_CODE_NO> (489)
2545748

>  <LOCATION_CODE> (489)
PTNCS

>  <AMOUNT_CURRENT> (489)
29.4

$$$$
WAY-383879
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    1.4625    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  1  0  0  0  0
 11  2  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 14  2  2  0  0  0  0
 15  5  2  0  0  0  0
 16  9  1  0  0  0  0
 17 16  1  0  0  0  0
 18  6  1  0  0  0  0
 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 12 10  2  0  0  0  0
 20 16  2  0  0  0  0
M  END
>  <Mol_ID> (490)
490

>  <Formula> (490)
C15H11ClO4

>  <MolWeight> (490)
290.69844

>  <PCAT_CMPD_ID> (490)
WAY-383879

>  <CNC_ID> (490)
359399917

>  <transfer_container_id> (490)
PTN000000072

>  <COMPOUND_NUMBER> (490)
WAY-383879

>  <BAR_CODE_NO> (490)
2545976

>  <LOCATION_CODE> (490)
PTNCS

>  <AMOUNT_CURRENT> (490)
32.5

$$$$
WAY-384155
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    1.6673   -1.1422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 11  8  1  0  0  0  0
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 13  3  1  0  0  0  0
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 15  7  1  0  0  0  0
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 17 13  2  0  0  0  0
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 19 21  2  0  0  0  0
 10  7  1  0  0  0  0
M  END
>  <Mol_ID> (491)
491

>  <Formula> (491)
C15H13N3OS2

>  <MolWeight> (491)
315.41322

>  <PCAT_CMPD_ID> (491)
WAY-384155

>  <CNC_ID> (491)
359400157

>  <transfer_container_id> (491)
PTN000000072

>  <COMPOUND_NUMBER> (491)
WAY-384155

>  <BAR_CODE_NO> (491)
2546254

>  <LOCATION_CODE> (491)
PTNCS

>  <AMOUNT_CURRENT> (491)
32.6

$$$$
WAY-384234
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
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 30 29  1  0  0  0  0
 25 24  2  0  0  0  0
M  END
>  <Mol_ID> (492)
492

>  <Formula> (492)
C22H18N4O3S

>  <MolWeight> (492)
418.46832

>  <PCAT_CMPD_ID> (492)
WAY-384234

>  <CNC_ID> (492)
359400221

>  <transfer_container_id> (492)
PTN000000072

>  <COMPOUND_NUMBER> (492)
WAY-384234

>  <BAR_CODE_NO> (492)
2546380

>  <LOCATION_CODE> (492)
PTNCS

>  <AMOUNT_CURRENT> (492)
32.7

$$$$
WAY-384317
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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    2.8167   -3.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8292   -4.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  2  0  0  0  0
 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  3  0  0  0  0
 14  2  2  0  0  0  0
 15  5  1  0  0  0  0
 16  7  1  0  0  0  0
 17  9  1  0  0  0  0
 18 11  1  0  0  0  0
 19 12  1  0  0  0  0
 20 15  1  0  0  0  0
 21 16  2  0  0  0  0
 22 21  1  0  0  0  0
 23 19  2  0  0  0  0
 24 18  2  0  0  0  0
  9  5  1  0  0  0  0
 17 22  2  0  0  0  0
 12 11  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (493)
493

>  <Formula> (493)
C19H14N4O

>  <MolWeight> (493)
314.34066

>  <PCAT_CMPD_ID> (493)
WAY-384317

>  <CNC_ID> (493)
359400304

>  <transfer_container_id> (493)
PTN000000072

>  <COMPOUND_NUMBER> (493)
WAY-384317

>  <BAR_CODE_NO> (493)
2546566

>  <LOCATION_CODE> (493)
PTNCS

>  <AMOUNT_CURRENT> (493)
32.3

$$$$
WAY-384318
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
    5.2375   -3.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4417   -3.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0375   -2.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8417   -2.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  2  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  8  1  0  0  0  0
 10  2  1  0  0  0  0
 11  5  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  3  0  0  0  0
 14  4  2  0  0  0  0
 15  8  2  0  0  0  0
 16  9  2  0  0  0  0
 17 11  1  0  0  0  0
 18 12  1  0  0  0  0
 19 15  1  0  0  0  0
 20 19  2  0  0  0  0
 21 18  2  0  0  0  0
 22 17  2  0  0  0  0
 12 11  2  0  0  0  0
 21 22  1  0  0  0  0
  9  6  1  0  0  0  0
 16 20  1  0  0  0  0
M  END
>  <Mol_ID> (494)
494

>  <Formula> (494)
C17H10N4O

>  <MolWeight> (494)
286.2875

>  <PCAT_CMPD_ID> (494)
WAY-384318

>  <CNC_ID> (494)
359400305

>  <transfer_container_id> (494)
PTN000000072

>  <COMPOUND_NUMBER> (494)
WAY-384318

>  <BAR_CODE_NO> (494)
2546569

>  <LOCATION_CODE> (494)
PTNCS

>  <AMOUNT_CURRENT> (494)
32.7

$$$$
WAY-384331
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
    9.5417   -7.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2542   -6.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7625   -7.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7292   -6.0542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5167   -6.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4417   -6.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2167   -7.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292   -6.0500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.2042   -6.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1542   -8.4042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1750   -5.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0292   -6.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7667   -6.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11  8  1  0  0  0  0
 12  6  2  0  0  0  0
 13 15  2  0  0  0  0
 14  7  2  0  0  0  0
 15 19  1  0  0  0  0
 16  3  1  0  0  0  0
 17  9  1  0  0  0  0
 18  7  1  0  0  0  0
 19 11  2  0  0  0  0
 20  5  1  0  0  0  0
 21 13  1  0  0  0  0
 22 18  1  0  0  0  0
 23 22  1  0  0  0  0
  2  4  1  0  0  0  0
 13  9  1  0  0  0  0
M  END
>  <Mol_ID> (495)
495

>  <Formula> (495)
C17H19ClN2O3

>  <MolWeight> (495)
334.79736

>  <PCAT_CMPD_ID> (495)
WAY-384331

>  <CNC_ID> (495)
359400318

>  <transfer_container_id> (495)
PTN000000072

>  <COMPOUND_NUMBER> (495)
WAY-384331

>  <BAR_CODE_NO> (495)
2546429

>  <LOCATION_CODE> (495)
PTNCS

>  <AMOUNT_CURRENT> (495)
32.6

$$$$
WAY-384332
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    6.4625   -4.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7042   -4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6167   -3.9042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    7.5792   -5.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  7  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
  9  4  1  0  0  0  0
 10  2  2  0  0  0  0
 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14  6  1  0  0  0  0
 15 17  1  0  0  0  0
 16  4  1  0  0  0  0
 17  8  2  0  0  0  0
 18 13  1  0  0  0  0
 19 15  1  0  0  0  0
 20  7  1  0  0  0  0
  9 15  2  0  0  0  0
 13 12  1  0  0  0  0
 18 14  1  0  0  0  0
M  END
>  <Mol_ID> (496)
496

>  <Formula> (496)
C16H19ClFNO

>  <MolWeight> (496)
295.7795632

>  <PCAT_CMPD_ID> (496)
WAY-384332

>  <CNC_ID> (496)
359400319

>  <transfer_container_id> (496)
PTN000000072

>  <COMPOUND_NUMBER> (496)
WAY-384332

>  <BAR_CODE_NO> (496)
2546408

>  <LOCATION_CODE> (496)
PTNCS

>  <AMOUNT_CURRENT> (496)
32.4

$$$$
WAY-384383
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    6.4125   -4.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9792   -5.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9792   -4.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6917   -6.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9125   -4.1667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
 12  2  2  0  0  0  0
 13  4  2  0  0  0  0
 14  9  1  0  0  0  0
 15 11  1  0  0  0  0
 16 10  1  0  0  0  0
 17 15  1  0  0  0  0
 18  6  2  0  0  0  0
 19  7  2  0  0  0  0
 20 15  2  0  0  0  0
 21 17  1  0  0  0  0
 22 17  2  0  0  0  0
 23 19  1  0  0  0  0
 24 23  2  0  0  0  0
 25 20  1  0  0  0  0
 26 25  2  0  0  0  0
 16 14  2  0  0  0  0
  3  6  1  0  0  0  0
 24 18  1  0  0  0  0
 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (497)
497

>  <Formula> (497)
C20H15N3O2S

>  <MolWeight> (497)
361.417

>  <PCAT_CMPD_ID> (497)
WAY-384383

>  <CNC_ID> (497)
359400361

>  <transfer_container_id> (497)
PTN000000072

>  <COMPOUND_NUMBER> (497)
WAY-384383

>  <BAR_CODE_NO> (497)
2546441

>  <LOCATION_CODE> (497)
PTNCS

>  <AMOUNT_CURRENT> (497)
29.6

$$$$
WAY-384385
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    4.8542   -7.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5167   -7.7792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1917   -7.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1167   -6.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.9417   -6.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 18 14  1  0  0  0  0
 19 16  1  0  0  0  0
  7  3  2  0  0  0  0
 16 18  2  0  0  0  0
M  END
>  <Mol_ID> (498)
498

>  <Formula> (498)
C10H6ClF3N4O

>  <MolWeight> (498)
290.6290496

>  <PCAT_CMPD_ID> (498)
WAY-384385

>  <CNC_ID> (498)
359400363

>  <transfer_container_id> (498)
PTN000000072

>  <COMPOUND_NUMBER> (498)
WAY-384385

>  <BAR_CODE_NO> (498)
2546443

>  <LOCATION_CODE> (498)
PTNCS

>  <AMOUNT_CURRENT> (498)
32.5

$$$$
WAY-384453
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  9  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
 14 15  1  0  0  0  0
 15  5  1  0  0  0  0
 16 10  1  0  0  0  0
 17  7  1  0  0  0  0
 18 10  1  0  0  0  0
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 18 20  2  0  0  0  0
  8 11  2  0  0  0  0
M  END
>  <Mol_ID> (499)
499

>  <Formula> (499)
C14H12FNO3S

>  <MolWeight> (499)
293.3133832

>  <PCAT_CMPD_ID> (499)
WAY-384453

>  <CNC_ID> (499)
359400424

>  <transfer_container_id> (499)
PTN000000072

>  <COMPOUND_NUMBER> (499)
WAY-384453

>  <BAR_CODE_NO> (499)
2546657

>  <LOCATION_CODE> (499)
PTNCS

>  <AMOUNT_CURRENT> (499)
32.2

$$$$
WAY-384458
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   -1.7311    0.9601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  1  0  0  0  0
 13  4  1  0  0  0  0
 14  6  1  0  0  0  0
 15 10  1  0  0  0  0
 16 10  1  0  0  0  0
 17 12  2  0  0  0  0
 18 17  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  1  0  0  0  0
 21 20  1  0  0  0  0
 18 14  2  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (500)
500

>  <Formula> (500)
C16H21NO3S

>  <MolWeight> (500)
307.40784

>  <PCAT_CMPD_ID> (500)
WAY-384458

>  <CNC_ID> (500)
359400429

>  <transfer_container_id> (500)
PTN000000072

>  <COMPOUND_NUMBER> (500)
WAY-384458

>  <BAR_CODE_NO> (500)
2546637

>  <LOCATION_CODE> (500)
PTNCS

>  <AMOUNT_CURRENT> (500)
32.8

$$$$
WAY-384489
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    5.4667   -0.6500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
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 13 11  1  0  0  0  0
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 16  5  2  0  0  0  0
 17  6  2  0  0  0  0
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M  END
>  <Mol_ID> (501)
501

>  <Formula> (501)
C25H22N2O4

>  <MolWeight> (501)
414.45318

>  <PCAT_CMPD_ID> (501)
WAY-384489

>  <CNC_ID> (501)
359400459

>  <transfer_container_id> (501)
PTN000000072

>  <COMPOUND_NUMBER> (501)
WAY-384489

>  <BAR_CODE_NO> (501)
2546620

>  <LOCATION_CODE> (501)
PTNCS

>  <AMOUNT_CURRENT> (501)
32.5

$$$$
WAY-384730
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (502)
502

>  <Formula> (502)
C24H20N4O4S

>  <MolWeight> (502)
460.505

>  <PCAT_CMPD_ID> (502)
WAY-384730

>  <CNC_ID> (502)
359400693

>  <transfer_container_id> (502)
PTN000000072

>  <COMPOUND_NUMBER> (502)
WAY-384730

>  <BAR_CODE_NO> (502)
2546535

>  <LOCATION_CODE> (502)
PTNCS

>  <AMOUNT_CURRENT> (502)
32.5

$$$$
WAY-384734
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  5  1  0  0  0  0
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 14  6  2  0  0  0  0
 15  4  2  0  0  0  0
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 17  7  2  0  0  0  0
 18 13  2  0  0  0  0
 19 16  2  0  0  0  0
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 21  9  2  0  0  0  0
 22 16  1  0  0  0  0
 23 10  2  0  0  0  0
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 25 18  1  0  0  0  0
 26 21  1  0  0  0  0
 27 26  2  0  0  0  0
 28 24  2  0  0  0  0
 29 28  1  0  0  0  0
 10  5  1  0  0  0  0
  2  6  1  0  0  0  0
 27 23  1  0  0  0  0
 29 25  2  0  0  0  0
M  END
>  <Mol_ID> (503)
503

>  <Formula> (503)
C20H13ClN2O4S2

>  <MolWeight> (503)
444.91122

>  <PCAT_CMPD_ID> (503)
WAY-384734

>  <CNC_ID> (503)
359400697

>  <transfer_container_id> (503)
PTN000000072

>  <COMPOUND_NUMBER> (503)
WAY-384734

>  <BAR_CODE_NO> (503)
2546540

>  <LOCATION_CODE> (503)
PTNCS

>  <AMOUNT_CURRENT> (503)
17.3

$$$$
WAY-384742
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.8208    2.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  2  2  0  0  0  0
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  7  6  3  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10 12  1  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 12  1  0  0  0  0
 17 16  1  0  0  0  0
 18 15  2  0  0  0  0
 19 14  1  0  0  0  0
 20 18  1  0  0  0  0
  5  4  1  0  0  0  0
 13 17  1  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (504)
504

>  <Formula> (504)
C15H15N3O2

>  <MolWeight> (504)
269.2985

>  <PCAT_CMPD_ID> (504)
WAY-384742

>  <CNC_ID> (504)
359400705

>  <transfer_container_id> (504)
PTN000000072

>  <COMPOUND_NUMBER> (504)
WAY-384742

>  <BAR_CODE_NO> (504)
2546547

>  <LOCATION_CODE> (504)
PTNCS

>  <AMOUNT_CURRENT> (504)
32.2

$$$$
WAY-385269
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  5 10  1  0  0  0  0
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  7 11  2  0  0  0  0
  8  1  1  0  0  0  0
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 10 18  2  0  0  0  0
 11  8  1  0  0  0  0
 12  6  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  2  2  0  0  0  0
 16 12  2  0  0  0  0
 17  8  2  0  0  0  0
 18 17  1  0  0  0  0
 19 12  1  0  0  0  0
 20  6  2  0  0  0  0
 21  9  2  0  0  0  0
 22 23  2  0  0  0  0
 23 21  1  0  0  0  0
 10  7  1  0  0  0  0
  5  2  1  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (505)
505

>  <Formula> (505)
C14H11N3O5S

>  <MolWeight> (505)
333.31924

>  <PCAT_CMPD_ID> (505)
WAY-385269

>  <CNC_ID> (505)
359401185

>  <transfer_container_id> (505)
PTN000000072

>  <COMPOUND_NUMBER> (505)
WAY-385269

>  <BAR_CODE_NO> (505)
2547382

>  <LOCATION_CODE> (505)
PTNCS

>  <AMOUNT_CURRENT> (505)
32.8

$$$$
WAY-385513
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    0.9500    0.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
 12  2  2  0  0  0  0
 13  8  2  0  0  0  0
 14  3  2  0  0  0  0
 15  8  1  0  0  0  0
 16  7  1  0  0  0  0
 17 13  1  0  0  0  0
 18 15  2  0  0  0  0
 19 18  1  0  0  0  0
 20 10  1  0  0  0  0
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 27 25  1  0  0  0  0
 11 10  2  0  0  0  0
 26 27  2  0  0  0  0
 17 19  2  0  0  0  0
M  END
>  <Mol_ID> (506)
506

>  <Formula> (506)
C22H21NO3S

>  <MolWeight> (506)
379.47204

>  <PCAT_CMPD_ID> (506)
WAY-385513

>  <CNC_ID> (506)
359401354

>  <transfer_container_id> (506)
PTN000000072

>  <COMPOUND_NUMBER> (506)
WAY-385513

>  <BAR_CODE_NO> (506)
2547540

>  <LOCATION_CODE> (506)
PTNCS

>  <AMOUNT_CURRENT> (506)
32.5

$$$$
CL-99264
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  6  7  2  0  0  0  0
  9 11  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (507)
507

>  <Formula> (507)
C13H11N3

>  <MolWeight> (507)
209.24654

>  <PCAT_CMPD_ID> (507)
CL-99264

>  <CNC_ID> (507)
359407752

>  <transfer_container_id> (507)
PTN000000073

>  <COMPOUND_NUMBER> (507)
CL-99264

>  <BAR_CODE_NO> (507)
3910548

>  <LOCATION_CODE> (507)
PTNCS

>  <AMOUNT_CURRENT> (507)
33.3

$$$$
WAY-133255
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10 17  2  0  0  0  0
  3  4  1  0  0  0  0
 10 18  2  0  0  0  0
M  END
>  <Mol_ID> (508)
508

>  <Formula> (508)
C13H10N2O2S

>  <MolWeight> (508)
258.2957

>  <PCAT_CMPD_ID> (508)
WAY-133255

>  <CNC_ID> (508)
359407870

>  <transfer_container_id> (508)
PTN000000073

>  <COMPOUND_NUMBER> (508)
WAY-133255

>  <BAR_CODE_NO> (508)
3909763

>  <LOCATION_CODE> (508)
PTNCS

>  <AMOUNT_CURRENT> (508)
33.3

$$$$
WAY-226683
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 12 14  2  0  0  0  0
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 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
 17 19  2  0  0  0  0
  9 10  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (509)
509

>  <Formula> (509)
C14H14N2O3

>  <MolWeight> (509)
258.27256

>  <PCAT_CMPD_ID> (509)
WAY-226683

>  <CNC_ID> (509)
359407985

>  <transfer_container_id> (509)
PTN000000073

>  <COMPOUND_NUMBER> (509)
WAY-226683

>  <BAR_CODE_NO> (509)
3910539

>  <LOCATION_CODE> (509)
PTNCS

>  <AMOUNT_CURRENT> (509)
33.5

$$$$
WAY-233656
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 11  4  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  2  2  0  0  0  0
 15  2  2  0  0  0  0
 16  5  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19  8  1  0  0  0  0
 20 10  1  0  0  0  0
 21  9  1  0  0  0  0
 22 11  1  0  0  0  0
 23 24  1  0  0  0  0
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 25 16  1  0  0  0  0
 26 22  1  0  0  0  0
 27 20  1  0  0  0  0
 28 19  1  0  0  0  0
 29 21  1  0  0  0  0
 17 19  1  0  0  0  0
 23  7  2  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (510)
510

>  <Formula> (510)
C18H27ClN2O6S2

>  <MolWeight> (510)
466.99978

>  <PCAT_CMPD_ID> (510)
WAY-233656

>  <CNC_ID> (510)
359408043

>  <transfer_container_id> (510)
PTN000000073

>  <COMPOUND_NUMBER> (510)
WAY-233656

>  <BAR_CODE_NO> (510)
3909653

>  <LOCATION_CODE> (510)
PTNCS

>  <AMOUNT_CURRENT> (510)
33.1

$$$$
WAY-305649
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    2.4069    0.9345    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
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 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (511)
511

>  <Formula> (511)
C18H21NO4S3

>  <MolWeight> (511)
411.55864

>  <PCAT_CMPD_ID> (511)
WAY-305649

>  <CNC_ID> (511)
359408150

>  <transfer_container_id> (511)
PTN000000073

>  <COMPOUND_NUMBER> (511)
WAY-305649

>  <BAR_CODE_NO> (511)
3908964

>  <LOCATION_CODE> (511)
PTNCS

>  <AMOUNT_CURRENT> (511)
33.7

$$$$
WAY-305809
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
 17 19  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (512)
512

>  <Formula> (512)
C23H21FN4O5

>  <MolWeight> (512)
452.4350432

>  <PCAT_CMPD_ID> (512)
WAY-305809

>  <CNC_ID> (512)
359408310

>  <transfer_container_id> (512)
PTN000000073

>  <COMPOUND_NUMBER> (512)
WAY-305809

>  <BAR_CODE_NO> (512)
3909145

>  <LOCATION_CODE> (512)
PTNCS

>  <AMOUNT_CURRENT> (512)
33.9

$$$$
WAY-305820
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 17 18  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (513)
513

>  <Formula> (513)
C18H22N6O2

>  <MolWeight> (513)
354.40628

>  <PCAT_CMPD_ID> (513)
WAY-305820

>  <CNC_ID> (513)
359408321

>  <transfer_container_id> (513)
PTN000000073

>  <COMPOUND_NUMBER> (513)
WAY-305820

>  <BAR_CODE_NO> (513)
3909158

>  <LOCATION_CODE> (513)
PTNCS

>  <AMOUNT_CURRENT> (513)
33.6

$$$$
WAY-305857
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (514)
514

>  <Formula> (514)
C15H24N6O2

>  <MolWeight> (514)
320.39006

>  <PCAT_CMPD_ID> (514)
WAY-305857

>  <CNC_ID> (514)
359408358

>  <transfer_container_id> (514)
PTN000000073

>  <COMPOUND_NUMBER> (514)
WAY-305857

>  <BAR_CODE_NO> (514)
3909201

>  <LOCATION_CODE> (514)
PTNCS

>  <AMOUNT_CURRENT> (514)
33.8

$$$$
WAY-305865
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
    0.6621    0.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  8 13  1  0  0  0  0
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 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
  7 10  1  0  0  0  0
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 11 12  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (515)
515

>  <Formula> (515)
C18H16N2O2

>  <MolWeight> (515)
292.33184

>  <PCAT_CMPD_ID> (515)
WAY-305865

>  <CNC_ID> (515)
359408366

>  <transfer_container_id> (515)
PTN000000073

>  <COMPOUND_NUMBER> (515)
WAY-305865

>  <BAR_CODE_NO> (515)
3909212

>  <LOCATION_CODE> (515)
PTNCS

>  <AMOUNT_CURRENT> (515)
33.9

$$$$
WAY-306034
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  5  7  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (516)
516

>  <Formula> (516)
C10H7NO5S

>  <MolWeight> (516)
253.23128

>  <PCAT_CMPD_ID> (516)
WAY-306034

>  <CNC_ID> (516)
359408535

>  <transfer_container_id> (516)
PTN000000073

>  <COMPOUND_NUMBER> (516)
WAY-306034

>  <BAR_CODE_NO> (516)
3909420

>  <LOCATION_CODE> (516)
PTNCS

>  <AMOUNT_CURRENT> (516)
33.6

$$$$
WAY-306738
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.3552   -0.7828    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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 21 23  1  0  0  0  0
  6  9  1  0  0  0  0
 14 17  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (517)
517

>  <Formula> (517)
C16H16BrNO3S2

>  <MolWeight> (517)
414.33714

>  <PCAT_CMPD_ID> (517)
WAY-306738

>  <CNC_ID> (517)
359409236

>  <transfer_container_id> (517)
PTN000000073

>  <COMPOUND_NUMBER> (517)
WAY-306738

>  <BAR_CODE_NO> (517)
3910347

>  <LOCATION_CODE> (517)
PTNCS

>  <AMOUNT_CURRENT> (517)
33.4

$$$$
WAY-306739
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.6069    0.4203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
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 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (518)
518

>  <Formula> (518)
C17H21N5O3

>  <MolWeight> (518)
343.38034

>  <PCAT_CMPD_ID> (518)
WAY-306739

>  <CNC_ID> (518)
359409237

>  <transfer_container_id> (518)
PTN000000073

>  <COMPOUND_NUMBER> (518)
WAY-306739

>  <BAR_CODE_NO> (518)
3910348

>  <LOCATION_CODE> (518)
PTNCS

>  <AMOUNT_CURRENT> (518)
33.2

$$$$
WAY-306939
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  4  8  2  0  0  0  0
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  5 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
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 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
  6 10  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (519)
519

>  <Formula> (519)
C13H13N3O3S2

>  <MolWeight> (519)
323.39062

>  <PCAT_CMPD_ID> (519)
WAY-306939

>  <CNC_ID> (519)
359409437

>  <transfer_container_id> (519)
PTN000000073

>  <COMPOUND_NUMBER> (519)
WAY-306939

>  <BAR_CODE_NO> (519)
3910581

>  <LOCATION_CODE> (519)
PTNCS

>  <AMOUNT_CURRENT> (519)
33.6

$$$$
WAY-306940-A
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (520)
520

>  <Formula> (520)
C16H17NO3

>  <MolWeight> (520)
271.31108

>  <PCAT_CMPD_ID> (520)
WAY-306940-A

>  <CNC_ID> (520)
359409438

>  <transfer_container_id> (520)
PTN000000073

>  <COMPOUND_NUMBER> (520)
WAY-306940-A

>  <BAR_CODE_NO> (520)
3910583

>  <LOCATION_CODE> (520)
PTNCS

>  <AMOUNT_CURRENT> (520)
33.5

$$$$
WAY-306944
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
   -1.8276   -0.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8276   -1.7069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 21 24  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (521)
521

>  <Formula> (521)
C26H26N2O4

>  <MolWeight> (521)
430.49564

>  <PCAT_CMPD_ID> (521)
WAY-306944

>  <CNC_ID> (521)
359409442

>  <transfer_container_id> (521)
PTN000000073

>  <COMPOUND_NUMBER> (521)
WAY-306944

>  <BAR_CODE_NO> (521)
3910592

>  <LOCATION_CODE> (521)
PTNCS

>  <AMOUNT_CURRENT> (521)
33.8

$$$$
WAY-306947
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (522)
522

>  <Formula> (522)
C11H10N4O3

>  <MolWeight> (522)
246.2221

>  <PCAT_CMPD_ID> (522)
WAY-306947

>  <CNC_ID> (522)
359409445

>  <transfer_container_id> (522)
PTN000000073

>  <COMPOUND_NUMBER> (522)
WAY-306947

>  <BAR_CODE_NO> (522)
3910598

>  <LOCATION_CODE> (522)
PTNCS

>  <AMOUNT_CURRENT> (522)
33.1

$$$$
WAY-306952
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 13 15  1  0  0  0  0
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 15 19  1  0  0  0  0
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  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (523)
523

>  <Formula> (523)
C18H16FN3O2S2

>  <MolWeight> (523)
389.4669432

>  <PCAT_CMPD_ID> (523)
WAY-306952

>  <CNC_ID> (523)
359409450

>  <transfer_container_id> (523)
PTN000000073

>  <COMPOUND_NUMBER> (523)
WAY-306952

>  <BAR_CODE_NO> (523)
3910608

>  <LOCATION_CODE> (523)
PTNCS

>  <AMOUNT_CURRENT> (523)
33.4

$$$$
WAY-306955
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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   -3.1094    0.1805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  9  2  0  0  0  0
 12 15  1  0  0  0  0
 13 14  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (524)
524

>  <Formula> (524)
C17H14N4S

>  <MolWeight> (524)
306.38486

>  <PCAT_CMPD_ID> (524)
WAY-306955

>  <CNC_ID> (524)
359409453

>  <transfer_container_id> (524)
PTN000000073

>  <COMPOUND_NUMBER> (524)
WAY-306955

>  <BAR_CODE_NO> (524)
3910613

>  <LOCATION_CODE> (524)
PTNCS

>  <AMOUNT_CURRENT> (524)
33.4

$$$$
WAY-306964
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -0.4759   -0.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3034   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0690    0.3966    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    0.7586    0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4828    1.1103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2310    1.8552    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  7 14  1  0  0  0  0
 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  2  0  0  0  0
 13 18  1  0  0  0  0
 14 19  2  0  0  0  0
 15 20  1  0  0  0  0
 18 21  2  0  0  0  0
 18 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 22 25  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
 16 20  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (525)
525

>  <Formula> (525)
C19H13ClN2O3

>  <MolWeight> (525)
352.77112

>  <PCAT_CMPD_ID> (525)
WAY-306964

>  <CNC_ID> (525)
359409462

>  <transfer_container_id> (525)
PTN000000073

>  <COMPOUND_NUMBER> (525)
WAY-306964

>  <BAR_CODE_NO> (525)
3910628

>  <LOCATION_CODE> (525)
PTNCS

>  <AMOUNT_CURRENT> (525)
33.3

$$$$
WAY-306970
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  2  0  0  0  0
  9 15  1  0  0  0  0
 11 16  2  0  0  0  0
 12 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  2  0  0  0  0
 18 20  2  0  0  0  0
  5  7  1  0  0  0  0
 10 11  1  0  0  0  0
 13 17  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (526)
526

>  <Formula> (526)
C16H13N3O

>  <MolWeight> (526)
263.29392

>  <PCAT_CMPD_ID> (526)
WAY-306970

>  <CNC_ID> (526)
359409468

>  <transfer_container_id> (526)
PTN000000073

>  <COMPOUND_NUMBER> (526)
WAY-306970

>  <BAR_CODE_NO> (526)
3910635

>  <LOCATION_CODE> (526)
PTNCS

>  <AMOUNT_CURRENT> (526)
33.8

$$$$
WAY-306974-A
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.8414    0.4966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (527)
527

>  <Formula> (527)
C18H20N4O3

>  <MolWeight> (527)
340.3764

>  <PCAT_CMPD_ID> (527)
WAY-306974-A

>  <CNC_ID> (527)
359409472

>  <transfer_container_id> (527)
PTN000000073

>  <COMPOUND_NUMBER> (527)
WAY-306974-A

>  <BAR_CODE_NO> (527)
3910639

>  <LOCATION_CODE> (527)
PTNCS

>  <AMOUNT_CURRENT> (527)
33.6

$$$$
WAY-306976-A
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.6862    0.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 15 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
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 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (528)
528

>  <Formula> (528)
C18H20N4O2

>  <MolWeight> (528)
324.377

>  <PCAT_CMPD_ID> (528)
WAY-306976-A

>  <CNC_ID> (528)
359409474

>  <transfer_container_id> (528)
PTN000000073

>  <COMPOUND_NUMBER> (528)
WAY-306976-A

>  <BAR_CODE_NO> (528)
3910641

>  <LOCATION_CODE> (528)
PTNCS

>  <AMOUNT_CURRENT> (528)
33.7

$$$$
WAY-306979-A
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.4966    0.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2310    0.7552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9310    0.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
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  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 17 18  1  0  0  0  0
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 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (529)
529

>  <Formula> (529)
C17H19N3O2

>  <MolWeight> (529)
297.35166

>  <PCAT_CMPD_ID> (529)
WAY-306979-A

>  <CNC_ID> (529)
359409477

>  <transfer_container_id> (529)
PTN000000073

>  <COMPOUND_NUMBER> (529)
WAY-306979-A

>  <BAR_CODE_NO> (529)
3910644

>  <LOCATION_CODE> (529)
PTNCS

>  <AMOUNT_CURRENT> (529)
33.4

$$$$
WAY-306980-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -1.6621    0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0931    0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (530)
530

>  <Formula> (530)
C17H18FN3O2

>  <MolWeight> (530)
315.3421232

>  <PCAT_CMPD_ID> (530)
WAY-306980-A

>  <CNC_ID> (530)
359409478

>  <transfer_container_id> (530)
PTN000000073

>  <COMPOUND_NUMBER> (530)
WAY-306980-A

>  <BAR_CODE_NO> (530)
3910645

>  <LOCATION_CODE> (530)
PTNCS

>  <AMOUNT_CURRENT> (530)
33.1

$$$$
WAY-306982-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -1.6621    0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6621    1.2759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  3  7  1  0  0  0  0
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  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (531)
531

>  <Formula> (531)
C18H21N3O2

>  <MolWeight> (531)
311.37824

>  <PCAT_CMPD_ID> (531)
WAY-306982-A

>  <CNC_ID> (531)
359409480

>  <transfer_container_id> (531)
PTN000000073

>  <COMPOUND_NUMBER> (531)
WAY-306982-A

>  <BAR_CODE_NO> (531)
3910647

>  <LOCATION_CODE> (531)
PTNCS

>  <AMOUNT_CURRENT> (531)
33.2

$$$$
WAY-306984-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.2310   -0.2450    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  3  1  0  0  0  0
 11  9  1  0  0  0  0
 12  4  1  0  0  0  0
 13  5  1  0  0  0  0
 14  7  1  0  0  0  0
 15 17  1  0  0  0  0
 16  9  1  0  0  0  0
 17 10  1  0  0  0  0
 18 19  1  0  0  0  0
 19 12  2  0  0  0  0
 20 14  2  0  0  0  0
 21 20  1  0  0  0  0
  5  3  1  0  0  0  0
 18 13  2  0  0  0  0
 21 16  2  0  0  0  0
M  END
>  <Mol_ID> (532)
532

>  <Formula> (532)
C16H16FN3O

>  <MolWeight> (532)
285.3161432

>  <PCAT_CMPD_ID> (532)
WAY-306984-A

>  <CNC_ID> (532)
359409482

>  <transfer_container_id> (532)
PTN000000073

>  <COMPOUND_NUMBER> (532)
WAY-306984-A

>  <BAR_CODE_NO> (532)
3910649

>  <LOCATION_CODE> (532)
PTNCS

>  <AMOUNT_CURRENT> (532)
33.7

$$$$
WAY-306991
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
   -0.1102    0.8171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 12 15  1  0  0  0  0
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 15 19  2  0  0  0  0
 16 20  1  0  0  0  0
 17 21  2  0  0  0  0
 19 22  1  0  0  0  0
  7  8  1  0  0  0  0
 11 13  2  0  0  0  0
 18 21  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (533)
533

>  <Formula> (533)
C19H14N2O

>  <MolWeight> (533)
286.32726

>  <PCAT_CMPD_ID> (533)
WAY-306991

>  <CNC_ID> (533)
359409489

>  <transfer_container_id> (533)
PTN000000073

>  <COMPOUND_NUMBER> (533)
WAY-306991

>  <BAR_CODE_NO> (533)
3910658

>  <LOCATION_CODE> (533)
PTNCS

>  <AMOUNT_CURRENT> (533)
33.6

$$$$
WAY-306995
csChFnd80/10111816222D

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 21 24  1  0  0  0  0
 26 28  2  0  0  0  0
M  END
>  <Mol_ID> (534)
534

>  <Formula> (534)
C21H25N3O5S

>  <MolWeight> (534)
431.5053

>  <PCAT_CMPD_ID> (534)
WAY-306995

>  <CNC_ID> (534)
359409493

>  <transfer_container_id> (534)
PTN000000073

>  <COMPOUND_NUMBER> (534)
WAY-306995

>  <BAR_CODE_NO> (534)
3910662

>  <LOCATION_CODE> (534)
PTNCS

>  <AMOUNT_CURRENT> (534)
33.3

$$$$
WAY-307048
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12  2  2  0  0  0  0
 13  7  2  0  0  0  0
 14  7  1  0  0  0  0
 15  4  2  0  0  0  0
 16  6  2  0  0  0  0
 17  9  2  0  0  0  0
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M  END
>  <Mol_ID> (535)
535

>  <Formula> (535)
C18H17NO5

>  <MolWeight> (535)
327.33128

>  <PCAT_CMPD_ID> (535)
WAY-307048

>  <CNC_ID> (535)
359409546

>  <transfer_container_id> (535)
PTN000000073

>  <COMPOUND_NUMBER> (535)
WAY-307048

>  <BAR_CODE_NO> (535)
3910720

>  <LOCATION_CODE> (535)
PTNCS

>  <AMOUNT_CURRENT> (535)
33.6

$$$$
WAY-307050
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (536)
536

>  <Formula> (536)
C11H6ClNO4S

>  <MolWeight> (536)
283.68764

>  <PCAT_CMPD_ID> (536)
WAY-307050

>  <CNC_ID> (536)
359409548

>  <transfer_container_id> (536)
PTN000000073

>  <COMPOUND_NUMBER> (536)
WAY-307050

>  <BAR_CODE_NO> (536)
3910723

>  <LOCATION_CODE> (536)
PTNCS

>  <AMOUNT_CURRENT> (536)
33.6

$$$$
WAY-307052
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (537)
537

>  <Formula> (537)
C12H11NO5S

>  <MolWeight> (537)
281.28444

>  <PCAT_CMPD_ID> (537)
WAY-307052

>  <CNC_ID> (537)
359409550

>  <transfer_container_id> (537)
PTN000000073

>  <COMPOUND_NUMBER> (537)
WAY-307052

>  <BAR_CODE_NO> (537)
3910727

>  <LOCATION_CODE> (537)
PTNCS

>  <AMOUNT_CURRENT> (537)
33.5

$$$$
WAY-307054
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (538)
538

>  <Formula> (538)
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>  <MolWeight> (538)
290.3127432

>  <PCAT_CMPD_ID> (538)
WAY-307054

>  <CNC_ID> (538)
359409552

>  <transfer_container_id> (538)
PTN000000073

>  <COMPOUND_NUMBER> (538)
WAY-307054

>  <BAR_CODE_NO> (538)
3910729

>  <LOCATION_CODE> (538)
PTNCS

>  <AMOUNT_CURRENT> (538)
33.1

$$$$
WAY-307066
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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    4.7069   -1.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
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  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
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 11 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 14 18  2  0  0  0  0
 16 19  1  0  0  0  0
 16 20  2  0  0  0  0
 19 21  2  0  0  0  0
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 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  6  8  1  0  0  0  0
 15 18  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (539)
539

>  <Formula> (539)
C18H12FNO3S

>  <MolWeight> (539)
341.3561832

>  <PCAT_CMPD_ID> (539)
WAY-307066

>  <CNC_ID> (539)
359409565

>  <transfer_container_id> (539)
PTN000000073

>  <COMPOUND_NUMBER> (539)
WAY-307066

>  <BAR_CODE_NO> (539)
3910743

>  <LOCATION_CODE> (539)
PTNCS

>  <AMOUNT_CURRENT> (539)
33.9

$$$$
WAY-307067
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    1.3655    0.2966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6414    0.0690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8862   -0.2103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.9897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0931    0.5621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4724   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6138    0.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7138   -0.9379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2138    1.2103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6138    0.3483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2276   -0.8793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  9 12  1  0  0  0  0
 11 14  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (540)
540

>  <Formula> (540)
C17H20N2O2

>  <MolWeight> (540)
284.3529

>  <PCAT_CMPD_ID> (540)
WAY-307067

>  <CNC_ID> (540)
359409566

>  <transfer_container_id> (540)
PTN000000073

>  <COMPOUND_NUMBER> (540)
WAY-307067

>  <BAR_CODE_NO> (540)
3910744

>  <LOCATION_CODE> (540)
PTNCS

>  <AMOUNT_CURRENT> (540)
33.9

$$$$
WAY-307069
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.0567    0.1943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0567   -0.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4683    0.4943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4683   -0.7117    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5757    0.4943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9933    0.1943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0947    0.1943    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9933   -0.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6107    0.4943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0313   -0.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  6  2  0  0  0  0
  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11  9  1  0  0  0  0
 12  2  2  0  0  0  0
 13  5  2  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16  3  1  0  0  0  0
 17  4  1  0  0  0  0
 18 17  1  0  0  0  0
 18 19  2  0  0  0  0
 20  6  1  0  0  0  0
 21  8  1  0  0  0  0
 20 22  2  0  0  0  0
 23 22  1  0  0  0  0
  4  8  1  0  0  0  0
 15 14  2  0  0  0  0
 23 21  2  0  0  0  0
M  END
>  <Mol_ID> (541)
541

>  <Formula> (541)
C16H13N3O3S

>  <MolWeight> (541)
327.35772

>  <PCAT_CMPD_ID> (541)
WAY-307069

>  <CNC_ID> (541)
359409568

>  <transfer_container_id> (541)
PTN000000073

>  <COMPOUND_NUMBER> (541)
WAY-307069

>  <BAR_CODE_NO> (541)
3910746

>  <LOCATION_CODE> (541)
PTNCS

>  <AMOUNT_CURRENT> (541)
33.8

$$$$
WAY-307081
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.2140    1.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2140    2.8135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4519    0.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0343    0.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
  8 14  3  0  0  0  0
  9 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (542)
542

>  <Formula> (542)
C17H13N3O2

>  <MolWeight> (542)
291.30402

>  <PCAT_CMPD_ID> (542)
WAY-307081

>  <CNC_ID> (542)
359409580

>  <transfer_container_id> (542)
PTN000000073

>  <COMPOUND_NUMBER> (542)
WAY-307081

>  <BAR_CODE_NO> (542)
3910760

>  <LOCATION_CODE> (542)
PTNCS

>  <AMOUNT_CURRENT> (542)
33.7

$$$$
WAY-307082
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 14 15  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (543)
543

>  <Formula> (543)
C15H20FNO4

>  <MolWeight> (543)
297.3220032

>  <PCAT_CMPD_ID> (543)
WAY-307082

>  <CNC_ID> (543)
359409581

>  <transfer_container_id> (543)
PTN000000073

>  <COMPOUND_NUMBER> (543)
WAY-307082

>  <BAR_CODE_NO> (543)
3910761

>  <LOCATION_CODE> (543)
PTNCS

>  <AMOUNT_CURRENT> (543)
33.8

$$$$
WAY-307094
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.1414   -0.2966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  5  7  2  0  0  0  0
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (544)
544

>  <Formula> (544)
C16H17N3O2

>  <MolWeight> (544)
283.32508

>  <PCAT_CMPD_ID> (544)
WAY-307094

>  <CNC_ID> (544)
359409593

>  <transfer_container_id> (544)
PTN000000073

>  <COMPOUND_NUMBER> (544)
WAY-307094

>  <BAR_CODE_NO> (544)
3910773

>  <LOCATION_CODE> (544)
PTNCS

>  <AMOUNT_CURRENT> (544)
33.9

$$$$
WAY-307096
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12  3  1  0  0  0  0
 13 10  2  0  0  0  0
 14 13  1  0  0  0  0
 15  9  1  0  0  0  0
 16  4  1  0  0  0  0
 17  5  1  0  0  0  0
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 22 19  1  0  0  0  0
  4  5  2  0  0  0  0
 20 21  1  0  0  0  0
 14 11  2  0  0  0  0
M  END
>  <Mol_ID> (545)
545

>  <Formula> (545)
C18H21N3O

>  <MolWeight> (545)
295.37884

>  <PCAT_CMPD_ID> (545)
WAY-307096

>  <CNC_ID> (545)
359409595

>  <transfer_container_id> (545)
PTN000000073

>  <COMPOUND_NUMBER> (545)
WAY-307096

>  <BAR_CODE_NO> (545)
3910775

>  <LOCATION_CODE> (545)
PTNCS

>  <AMOUNT_CURRENT> (545)
33.2

$$$$
WAY-307097
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 16 19  2  0  0  0  0
 16 20  1  0  0  0  0
 17 21  2  0  0  0  0
 20 22  2  0  0  0  0
  5  7  1  0  0  0  0
  8 10  2  0  0  0  0
 18 19  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (546)
546

>  <Formula> (546)
C19H16N2O

>  <MolWeight> (546)
288.34314

>  <PCAT_CMPD_ID> (546)
WAY-307097

>  <CNC_ID> (546)
359409596

>  <transfer_container_id> (546)
PTN000000073

>  <COMPOUND_NUMBER> (546)
WAY-307097

>  <BAR_CODE_NO> (546)
3910777

>  <LOCATION_CODE> (546)
PTNCS

>  <AMOUNT_CURRENT> (546)
33.3

$$$$
WAY-307098
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -3.4905    1.5621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 20  1  0  0  0  0
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 20 22  2  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (547)
547

>  <Formula> (547)
C17H17N3OS

>  <MolWeight> (547)
311.40138

>  <PCAT_CMPD_ID> (547)
WAY-307098

>  <CNC_ID> (547)
359409597

>  <transfer_container_id> (547)
PTN000000073

>  <COMPOUND_NUMBER> (547)
WAY-307098

>  <BAR_CODE_NO> (547)
3910779

>  <LOCATION_CODE> (547)
PTNCS

>  <AMOUNT_CURRENT> (547)
33.4

$$$$
WAY-307100
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 12 15  1  0  0  0  0
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M  END
>  <Mol_ID> (548)
548

>  <Formula> (548)
C15H11ClN2O

>  <MolWeight> (548)
270.71364

>  <PCAT_CMPD_ID> (548)
WAY-307100

>  <CNC_ID> (548)
359409599

>  <transfer_container_id> (548)
PTN000000073

>  <COMPOUND_NUMBER> (548)
WAY-307100

>  <BAR_CODE_NO> (548)
3910783

>  <LOCATION_CODE> (548)
PTNCS

>  <AMOUNT_CURRENT> (548)
33.9

$$$$
WAY-307104-A
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (549)
549

>  <Formula> (549)
C12H13N3O2

>  <MolWeight> (549)
231.25052

>  <PCAT_CMPD_ID> (549)
WAY-307104-A

>  <CNC_ID> (549)
359409603

>  <transfer_container_id> (549)
PTN000000073

>  <COMPOUND_NUMBER> (549)
WAY-307104-A

>  <BAR_CODE_NO> (549)
3910788

>  <LOCATION_CODE> (549)
PTNCS

>  <AMOUNT_CURRENT> (549)
33.6

$$$$
WAY-307112
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 13 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
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 25 27  1  0  0  0  0
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  6  9  1  0  0  0  0
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 20 21  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (550)
550

>  <Formula> (550)
C21H19ClN4O4

>  <MolWeight> (550)
426.85296

>  <PCAT_CMPD_ID> (550)
WAY-307112

>  <CNC_ID> (550)
359409611

>  <transfer_container_id> (550)
PTN000000073

>  <COMPOUND_NUMBER> (550)
WAY-307112

>  <BAR_CODE_NO> (550)
3910797

>  <LOCATION_CODE> (550)
PTNCS

>  <AMOUNT_CURRENT> (550)
33.7

$$$$
WAY-307134
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 14  2  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 19 20  1  0  0  0  0
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  5  8  1  0  0  0  0
 15 17  2  0  0  0  0
M  END
>  <Mol_ID> (551)
551

>  <Formula> (551)
C15H16N2O3S2

>  <MolWeight> (551)
336.42914

>  <PCAT_CMPD_ID> (551)
WAY-307134

>  <CNC_ID> (551)
359409633

>  <transfer_container_id> (551)
PTN000000073

>  <COMPOUND_NUMBER> (551)
WAY-307134

>  <BAR_CODE_NO> (551)
3910828

>  <LOCATION_CODE> (551)
PTNCS

>  <AMOUNT_CURRENT> (551)
33.9

$$$$
WAY-307140
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 10 13  2  0  0  0  0
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 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <Mol_ID> (552)
552

>  <Formula> (552)
C16H24N2O3

>  <MolWeight> (552)
292.37336

>  <PCAT_CMPD_ID> (552)
WAY-307140

>  <CNC_ID> (552)
359409639

>  <transfer_container_id> (552)
PTN000000073

>  <COMPOUND_NUMBER> (552)
WAY-307140

>  <BAR_CODE_NO> (552)
3910835

>  <LOCATION_CODE> (552)
PTNCS

>  <AMOUNT_CURRENT> (552)
33.6

$$$$
WAY-307142
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -1.9417   -0.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
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 20 21  2  0  0  0  0
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 22 24  2  0  0  0  0
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  7 11  1  0  0  0  0
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 10 15  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (553)
553

>  <Formula> (553)
C20H17ClN2O3

>  <MolWeight> (553)
368.81358

>  <PCAT_CMPD_ID> (553)
WAY-307142

>  <CNC_ID> (553)
359409641

>  <transfer_container_id> (553)
PTN000000073

>  <COMPOUND_NUMBER> (553)
WAY-307142

>  <BAR_CODE_NO> (553)
3910837

>  <LOCATION_CODE> (553)
PTNCS

>  <AMOUNT_CURRENT> (553)
33.5

$$$$
WAY-307143
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
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 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
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 16  8  1  0  0  0  0
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 19  7  2  0  0  0  0
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 28 26  1  0  0  0  0
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 20 25  1  0  0  0  0
 28 27  2  0  0  0  0
M  END
>  <Mol_ID> (554)
554

>  <Formula> (554)
C21H19N3O3S

>  <MolWeight> (554)
393.45886

>  <PCAT_CMPD_ID> (554)
WAY-307143

>  <CNC_ID> (554)
359409642

>  <transfer_container_id> (554)
PTN000000073

>  <COMPOUND_NUMBER> (554)
WAY-307143

>  <BAR_CODE_NO> (554)
3910838

>  <LOCATION_CODE> (554)
PTNCS

>  <AMOUNT_CURRENT> (554)
33

$$$$
WAY-307162
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 14 16  1  0  0  0  0
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M  END
>  <Mol_ID> (555)
555

>  <Formula> (555)
C18H26N2O5S

>  <MolWeight> (555)
382.47444

>  <PCAT_CMPD_ID> (555)
WAY-307162

>  <CNC_ID> (555)
359409661

>  <transfer_container_id> (555)
PTN000000073

>  <COMPOUND_NUMBER> (555)
WAY-307162

>  <BAR_CODE_NO> (555)
3910860

>  <LOCATION_CODE> (555)
PTNCS

>  <AMOUNT_CURRENT> (555)
33.3

$$$$
WAY-307163
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
   -0.5138    0.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (556)
556

>  <Formula> (556)
C14H21NO3S

>  <MolWeight> (556)
283.38644

>  <PCAT_CMPD_ID> (556)
WAY-307163

>  <CNC_ID> (556)
359409662

>  <transfer_container_id> (556)
PTN000000073

>  <COMPOUND_NUMBER> (556)
WAY-307163

>  <BAR_CODE_NO> (556)
3910861

>  <LOCATION_CODE> (556)
PTNCS

>  <AMOUNT_CURRENT> (556)
33.8

$$$$
WAY-307169
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (557)
557

>  <Formula> (557)
C16H12N4OS

>  <MolWeight> (557)
308.35768

>  <PCAT_CMPD_ID> (557)
WAY-307169

>  <CNC_ID> (557)
359409668

>  <transfer_container_id> (557)
PTN000000073

>  <COMPOUND_NUMBER> (557)
WAY-307169

>  <BAR_CODE_NO> (557)
3910875

>  <LOCATION_CODE> (557)
PTNCS

>  <AMOUNT_CURRENT> (557)
33.6

$$$$
WAY-307170-A
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  9 11  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (558)
558

>  <Formula> (558)
C16H23N3

>  <MolWeight> (558)
257.37392

>  <PCAT_CMPD_ID> (558)
WAY-307170-A

>  <CNC_ID> (558)
359409669

>  <transfer_container_id> (558)
PTN000000073

>  <COMPOUND_NUMBER> (558)
WAY-307170-A

>  <BAR_CODE_NO> (558)
3910876

>  <LOCATION_CODE> (558)
PTNCS

>  <AMOUNT_CURRENT> (558)
33.9

$$$$
WAY-307177
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (559)
559

>  <Formula> (559)
C19H24N2O4

>  <MolWeight> (559)
344.40486

>  <PCAT_CMPD_ID> (559)
WAY-307177

>  <CNC_ID> (559)
359409676

>  <transfer_container_id> (559)
PTN000000073

>  <COMPOUND_NUMBER> (559)
WAY-307177

>  <BAR_CODE_NO> (559)
3910883

>  <LOCATION_CODE> (559)
PTNCS

>  <AMOUNT_CURRENT> (559)
33.5

$$$$
WAY-307185
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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    2.7724   -3.0759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
  9 10  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (560)
560

>  <Formula> (560)
C16H19NO3

>  <MolWeight> (560)
273.32696

>  <PCAT_CMPD_ID> (560)
WAY-307185

>  <CNC_ID> (560)
359409684

>  <transfer_container_id> (560)
PTN000000073

>  <COMPOUND_NUMBER> (560)
WAY-307185

>  <BAR_CODE_NO> (560)
3910891

>  <LOCATION_CODE> (560)
PTNCS

>  <AMOUNT_CURRENT> (560)
33.6

$$$$
WAY-307189
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   -0.5483    1.4414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
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  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (561)
561

>  <Formula> (561)
C19H27N3O2

>  <MolWeight> (561)
329.43658

>  <PCAT_CMPD_ID> (561)
WAY-307189

>  <CNC_ID> (561)
359409688

>  <transfer_container_id> (561)
PTN000000073

>  <COMPOUND_NUMBER> (561)
WAY-307189

>  <BAR_CODE_NO> (561)
3910896

>  <LOCATION_CODE> (561)
PTNCS

>  <AMOUNT_CURRENT> (561)
33.2

$$$$
WAY-307202
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
    0.7586    1.1862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
  5  8  2  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (562)
562

>  <Formula> (562)
C11H14N2O2S

>  <MolWeight> (562)
238.30606

>  <PCAT_CMPD_ID> (562)
WAY-307202

>  <CNC_ID> (562)
359409701

>  <transfer_container_id> (562)
PTN000000073

>  <COMPOUND_NUMBER> (562)
WAY-307202

>  <BAR_CODE_NO> (562)
3910914

>  <LOCATION_CODE> (562)
PTNCS

>  <AMOUNT_CURRENT> (562)
33

$$$$
WAY-307211
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    0.5103   -0.3862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5103   -1.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2586    0.0448    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.3138   -0.1207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10 16  1  0  0  0  0
 15 17  1  0  0  0  0
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 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
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 25 27  2  0  0  0  0
 25 28  1  0  0  0  0
 26 29  1  0  0  0  0
 26 30  1  0  0  0  0
 29 31  1  0  0  0  0
  6  9  1  0  0  0  0
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 22 23  2  0  0  0  0
 27 29  1  0  0  0  0
M  END
>  <Mol_ID> (563)
563

>  <Formula> (563)
C19H20ClF3N6OS

>  <MolWeight> (563)
472.9149096

>  <PCAT_CMPD_ID> (563)
WAY-307211

>  <CNC_ID> (563)
359409710

>  <transfer_container_id> (563)
PTN000000073

>  <COMPOUND_NUMBER> (563)
WAY-307211

>  <BAR_CODE_NO> (563)
3910923

>  <LOCATION_CODE> (563)
PTNCS

>  <AMOUNT_CURRENT> (563)
33.5

$$$$
WAY-307212
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
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  8 11  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (564)
564

>  <Formula> (564)
C17H14O3

>  <MolWeight> (564)
266.29126

>  <PCAT_CMPD_ID> (564)
WAY-307212

>  <CNC_ID> (564)
359409711

>  <transfer_container_id> (564)
PTN000000073

>  <COMPOUND_NUMBER> (564)
WAY-307212

>  <BAR_CODE_NO> (564)
3910925

>  <LOCATION_CODE> (564)
PTNCS

>  <AMOUNT_CURRENT> (564)
29.8

$$$$
WAY-307214
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.6379    0.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (565)
565

>  <Formula> (565)
C18H13ClN2O3S

>  <MolWeight> (565)
372.82542

>  <PCAT_CMPD_ID> (565)
WAY-307214

>  <CNC_ID> (565)
359409713

>  <transfer_container_id> (565)
PTN000000073

>  <COMPOUND_NUMBER> (565)
WAY-307214

>  <BAR_CODE_NO> (565)
3910930

>  <LOCATION_CODE> (565)
PTNCS

>  <AMOUNT_CURRENT> (565)
33.3

$$$$
WAY-307216-A
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
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 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (566)
566

>  <Formula> (566)
C17H17FN2

>  <MolWeight> (566)
268.3286832

>  <PCAT_CMPD_ID> (566)
WAY-307216-A

>  <CNC_ID> (566)
359409715

>  <transfer_container_id> (566)
PTN000000073

>  <COMPOUND_NUMBER> (566)
WAY-307216-A

>  <BAR_CODE_NO> (566)
3910932

>  <LOCATION_CODE> (566)
PTNCS

>  <AMOUNT_CURRENT> (566)
33.3

$$$$
WAY-307217
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10 16  2  0  0  0  0
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 17 18  2  0  0  0  0
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M  END
>  <Mol_ID> (567)
567

>  <Formula> (567)
C20H16Cl2N2O3

>  <MolWeight> (567)
403.25864

>  <PCAT_CMPD_ID> (567)
WAY-307217

>  <CNC_ID> (567)
359409716

>  <transfer_container_id> (567)
PTN000000073

>  <COMPOUND_NUMBER> (567)
WAY-307217

>  <BAR_CODE_NO> (567)
3910934

>  <LOCATION_CODE> (567)
PTNCS

>  <AMOUNT_CURRENT> (567)
33.1

$$$$
WAY-307220
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 13 14  1  0  0  0  0
M  END
>  <Mol_ID> (568)
568

>  <Formula> (568)
C10H10N4O

>  <MolWeight> (568)
202.2126

>  <PCAT_CMPD_ID> (568)
WAY-307220

>  <CNC_ID> (568)
359409719

>  <transfer_container_id> (568)
PTN000000073

>  <COMPOUND_NUMBER> (568)
WAY-307220

>  <BAR_CODE_NO> (568)
3910938

>  <LOCATION_CODE> (568)
PTNCS

>  <AMOUNT_CURRENT> (568)
33.8

$$$$
WAY-307236
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (569)
569

>  <Formula> (569)
C16H19NO5

>  <MolWeight> (569)
305.32576

>  <PCAT_CMPD_ID> (569)
WAY-307236

>  <CNC_ID> (569)
359409735

>  <transfer_container_id> (569)
PTN000000073

>  <COMPOUND_NUMBER> (569)
WAY-307236

>  <BAR_CODE_NO> (569)
3910958

>  <LOCATION_CODE> (569)
PTNCS

>  <AMOUNT_CURRENT> (569)
33.8

$$$$
WAY-307243
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (570)
570

>  <Formula> (570)
C15H15N3OS

>  <MolWeight> (570)
285.3641

>  <PCAT_CMPD_ID> (570)
WAY-307243

>  <CNC_ID> (570)
359409742

>  <transfer_container_id> (570)
PTN000000073

>  <COMPOUND_NUMBER> (570)
WAY-307243

>  <BAR_CODE_NO> (570)
3910969

>  <LOCATION_CODE> (570)
PTNCS

>  <AMOUNT_CURRENT> (570)
33.1

$$$$
WAY-307246
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (571)
571

>  <Formula> (571)
C20H18O2

>  <MolWeight> (571)
290.35572

>  <PCAT_CMPD_ID> (571)
WAY-307246

>  <CNC_ID> (571)
359409745

>  <transfer_container_id> (571)
PTN000000073

>  <COMPOUND_NUMBER> (571)
WAY-307246

>  <BAR_CODE_NO> (571)
3910973

>  <LOCATION_CODE> (571)
PTNCS

>  <AMOUNT_CURRENT> (571)
33

$$$$
WAY-307248-A
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 13 18  1  0  0  0  0
M  END
>  <Mol_ID> (572)
572

>  <Formula> (572)
C18H24N4O2

>  <MolWeight> (572)
328.40876

>  <PCAT_CMPD_ID> (572)
WAY-307248-A

>  <CNC_ID> (572)
359409747

>  <transfer_container_id> (572)
PTN000000073

>  <COMPOUND_NUMBER> (572)
WAY-307248-A

>  <BAR_CODE_NO> (572)
3910977

>  <LOCATION_CODE> (572)
PTNCS

>  <AMOUNT_CURRENT> (572)
33.6

$$$$
WAY-307249
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (573)
573

>  <Formula> (573)
C15H12N2O2

>  <MolWeight> (573)
252.26798

>  <PCAT_CMPD_ID> (573)
WAY-307249

>  <CNC_ID> (573)
359409748

>  <transfer_container_id> (573)
PTN000000073

>  <COMPOUND_NUMBER> (573)
WAY-307249

>  <BAR_CODE_NO> (573)
3910978

>  <LOCATION_CODE> (573)
PTNCS

>  <AMOUNT_CURRENT> (573)
33.8

$$$$
WAY-307254
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (574)
574

>  <Formula> (574)
C16H15ClN2O2

>  <MolWeight> (574)
302.7555

>  <PCAT_CMPD_ID> (574)
WAY-307254

>  <CNC_ID> (574)
359409753

>  <transfer_container_id> (574)
PTN000000073

>  <COMPOUND_NUMBER> (574)
WAY-307254

>  <BAR_CODE_NO> (574)
3910984

>  <LOCATION_CODE> (574)
PTNCS

>  <AMOUNT_CURRENT> (574)
33.9

$$$$
WAY-307256
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (575)
575

>  <Formula> (575)
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>  <MolWeight> (575)
294.32626

>  <PCAT_CMPD_ID> (575)
WAY-307256

>  <CNC_ID> (575)
359409755

>  <transfer_container_id> (575)
PTN000000073

>  <COMPOUND_NUMBER> (575)
WAY-307256

>  <BAR_CODE_NO> (575)
3910987

>  <LOCATION_CODE> (575)
PTNCS

>  <AMOUNT_CURRENT> (575)
33.9

$$$$
WAY-307260
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (576)
576

>  <Formula> (576)
C11H10ClN3O2

>  <MolWeight> (576)
251.669

>  <PCAT_CMPD_ID> (576)
WAY-307260

>  <CNC_ID> (576)
359409759

>  <transfer_container_id> (576)
PTN000000073

>  <COMPOUND_NUMBER> (576)
WAY-307260

>  <BAR_CODE_NO> (576)
3910991

>  <LOCATION_CODE> (576)
PTNCS

>  <AMOUNT_CURRENT> (576)
33.9

$$$$
WAY-307267
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
 12  8  2  0  0  0  0
 13  7  1  0  0  0  0
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M  END
>  <Mol_ID> (577)
577

>  <Formula> (577)
C10H10N4OS

>  <MolWeight> (577)
234.2776

>  <PCAT_CMPD_ID> (577)
WAY-307267

>  <CNC_ID> (577)
359409766

>  <transfer_container_id> (577)
PTN000000073

>  <COMPOUND_NUMBER> (577)
WAY-307267

>  <BAR_CODE_NO> (577)
3911001

>  <LOCATION_CODE> (577)
PTNCS

>  <AMOUNT_CURRENT> (577)
33.8

$$$$
WAY-307277
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
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 17 18  1  0  0  0  0
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 21 22  1  0  0  0  0
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  9 14  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (578)
578

>  <Formula> (578)
C17H14N2O3

>  <MolWeight> (578)
294.30466

>  <PCAT_CMPD_ID> (578)
WAY-307277

>  <CNC_ID> (578)
359409776

>  <transfer_container_id> (578)
PTN000000073

>  <COMPOUND_NUMBER> (578)
WAY-307277

>  <BAR_CODE_NO> (578)
3911013

>  <LOCATION_CODE> (578)
PTNCS

>  <AMOUNT_CURRENT> (578)
33.6

$$$$
WAY-307369
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.8000   -0.0448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 11 14  1  0  0  0  0
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 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
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 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
  7  9  1  0  0  0  0
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (579)
579

>  <Formula> (579)
C18H16N2O5

>  <MolWeight> (579)
340.33004

>  <PCAT_CMPD_ID> (579)
WAY-307369

>  <CNC_ID> (579)
359409868

>  <transfer_container_id> (579)
PTN000000073

>  <COMPOUND_NUMBER> (579)
WAY-307369

>  <BAR_CODE_NO> (579)
3911136

>  <LOCATION_CODE> (579)
PTNCS

>  <AMOUNT_CURRENT> (579)
33

$$$$
WAY-307420
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  6  1  0  0  0  0
 12  1  1  0  0  0  0
 13  1  1  0  0  0  0
 14 18  1  0  0  0  0
 15  2  1  0  0  0  0
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 17 12  1  0  0  0  0
 18 19  1  0  0  0  0
 19 15  1  0  0  0  0
 17  4  1  0  0  0  0
  8  5  2  0  0  0  0
M  END
>  <Mol_ID> (580)
580

>  <Formula> (580)
C14H18ClNO3

>  <MolWeight> (580)
283.75062

>  <PCAT_CMPD_ID> (580)
WAY-307420

>  <CNC_ID> (580)
359409919

>  <transfer_container_id> (580)
PTN000000073

>  <COMPOUND_NUMBER> (580)
WAY-307420

>  <BAR_CODE_NO> (580)
3911201

>  <LOCATION_CODE> (580)
PTNCS

>  <AMOUNT_CURRENT> (580)
33.1

$$$$
WAY-307421
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  7  4  1  0  0  0  0
M  END
>  <Mol_ID> (581)
581

>  <Formula> (581)
C15H20ClNO2

>  <MolWeight> (581)
281.7778

>  <PCAT_CMPD_ID> (581)
WAY-307421

>  <CNC_ID> (581)
359409920

>  <transfer_container_id> (581)
PTN000000073

>  <COMPOUND_NUMBER> (581)
WAY-307421

>  <BAR_CODE_NO> (581)
3911202

>  <LOCATION_CODE> (581)
PTNCS

>  <AMOUNT_CURRENT> (581)
33.5

$$$$
WAY-307422
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  3  6  2  0  0  0  0
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  8 10  1  0  0  0  0
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 11 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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  6  8  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (582)
582

>  <Formula> (582)
C15H20ClNO3

>  <MolWeight> (582)
297.7772

>  <PCAT_CMPD_ID> (582)
WAY-307422

>  <CNC_ID> (582)
359409921

>  <transfer_container_id> (582)
PTN000000073

>  <COMPOUND_NUMBER> (582)
WAY-307422

>  <BAR_CODE_NO> (582)
3911203

>  <LOCATION_CODE> (582)
PTNCS

>  <AMOUNT_CURRENT> (582)
33.8

$$$$
WAY-307453
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
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 15 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
  7  9  1  0  0  0  0
 11 14  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (583)
583

>  <Formula> (583)
C18H16N2O2

>  <MolWeight> (583)
292.33184

>  <PCAT_CMPD_ID> (583)
WAY-307453

>  <CNC_ID> (583)
359409952

>  <transfer_container_id> (583)
PTN000000073

>  <COMPOUND_NUMBER> (583)
WAY-307453

>  <BAR_CODE_NO> (583)
3911237

>  <LOCATION_CODE> (583)
PTNCS

>  <AMOUNT_CURRENT> (583)
33.7

$$$$
WAY-307457
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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 29 32  1  0  0  0  0
 30 33  1  0  0  0  0
 31 34  1  0  0  0  0
  9 10  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 28 30  2  0  0  0  0
 33 34  1  0  0  0  0
M  END
>  <Mol_ID> (584)
584

>  <Formula> (584)
C24H22N4O5S

>  <MolWeight> (584)
478.52028

>  <PCAT_CMPD_ID> (584)
WAY-307457

>  <CNC_ID> (584)
359409956

>  <transfer_container_id> (584)
PTN000000073

>  <COMPOUND_NUMBER> (584)
WAY-307457

>  <BAR_CODE_NO> (584)
3911241

>  <LOCATION_CODE> (584)
PTNCS

>  <AMOUNT_CURRENT> (584)
33.4

$$$$
WAY-307474
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
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  9 14  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (585)
585

>  <Formula> (585)
C21H23N3O3

>  <MolWeight> (585)
365.42562

>  <PCAT_CMPD_ID> (585)
WAY-307474

>  <CNC_ID> (585)
359409973

>  <transfer_container_id> (585)
PTN000000073

>  <COMPOUND_NUMBER> (585)
WAY-307474

>  <BAR_CODE_NO> (585)
3911260

>  <LOCATION_CODE> (585)
PTNCS

>  <AMOUNT_CURRENT> (585)
33.8

$$$$
WAY-340333
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  5  1  0  0  0  0
 11  1  2  0  0  0  0
 12  6  2  0  0  0  0
 13  8  1  0  0  0  0
 14 12  1  0  0  0  0
 15  5  2  0  0  0  0
 16  7  1  0  0  0  0
 17 10  1  0  0  0  0
 18  2  2  0  0  0  0
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 20 18  1  0  0  0  0
 21  9  1  0  0  0  0
 22  9  1  0  0  0  0
 19  4  1  0  0  0  0
 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (586)
586

>  <Formula> (586)
C16H18N2O4

>  <MolWeight> (586)
302.32512

>  <PCAT_CMPD_ID> (586)
WAY-340333

>  <CNC_ID> (586)
359412340

>  <transfer_container_id> (586)
PTN000000073

>  <COMPOUND_NUMBER> (586)
WAY-340333

>  <BAR_CODE_NO> (586)
2550241

>  <LOCATION_CODE> (586)
PTNCS

>  <AMOUNT_CURRENT> (586)
32.9

$$$$
WAY-340705
csChFnd80/10111816222D

 16 16  0  0  0  0  0  0  0  0999 V2000
    3.7000    0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3875   -0.2375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
 13 14  1  0  0  0  0
 14 12  1  0  0  0  0
 15 11  1  0  0  0  0
 16 13  1  0  0  0  0
  5  4  1  0  0  0  0
M  END
>  <Mol_ID> (587)
587

>  <Formula> (587)
C10H19N5O

>  <MolWeight> (587)
225.29076

>  <PCAT_CMPD_ID> (587)
WAY-340705

>  <CNC_ID> (587)
359412390

>  <transfer_container_id> (587)
PTN000000073

>  <COMPOUND_NUMBER> (587)
WAY-340705

>  <BAR_CODE_NO> (587)
2550203

>  <LOCATION_CODE> (587)
PTNCS

>  <AMOUNT_CURRENT> (587)
32.7

$$$$
WAY-385377
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  9  1  0  0  0  0
  9  6  2  0  0  0  0
 10  7  2  0  0  0  0
 11 10  1  0  0  0  0
 12 18  1  0  0  0  0
 13  2  1  0  0  0  0
 14  8  1  0  0  0  0
 15  6  1  0  0  0  0
 16 12  1  0  0  0  0
 17 11  2  0  0  0  0
 18 15  2  0  0  0  0
 19 11  1  0  0  0  0
 20 14  1  0  0  0  0
 21 16  1  0  0  0  0
 22 13  2  0  0  0  0
 23 13  1  0  0  0  0
 24 23  2  0  0  0  0
 25 22  1  0  0  0  0
 26 24  1  0  0  0  0
  3  5  2  0  0  0  0
 12  8  2  0  0  0  0
 25 26  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (588)
588

>  <Formula> (588)
C20H17N3O3

>  <MolWeight> (588)
347.36728

>  <PCAT_CMPD_ID> (588)
WAY-385377

>  <CNC_ID> (588)
359412447

>  <transfer_container_id> (588)
PTN000000073

>  <COMPOUND_NUMBER> (588)
WAY-385377

>  <BAR_CODE_NO> (588)
2547785

>  <LOCATION_CODE> (588)
PTNCS

>  <AMOUNT_CURRENT> (588)
32.2

$$$$
WAY-385382
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    4.7042   -2.8375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  2  0  0  0  0
 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 13  5  1  0  0  0  0
 14  6  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  2  0  0  0  0
 17 12  1  0  0  0  0
 18 13  2  0  0  0  0
 19 14  2  0  0  0  0
 20 17  2  0  0  0  0
 21 16  1  0  0  0  0
 22 20  1  0  0  0  0
  6  5  2  0  0  0  0
 19 18  1  0  0  0  0
 22 21  2  0  0  0  0
M  END
>  <Mol_ID> (589)
589

>  <Formula> (589)
C17H14N2O3

>  <MolWeight> (589)
294.30466

>  <PCAT_CMPD_ID> (589)
WAY-385382

>  <CNC_ID> (589)
359412449

>  <transfer_container_id> (589)
PTN000000073

>  <COMPOUND_NUMBER> (589)
WAY-385382

>  <BAR_CODE_NO> (589)
2547787

>  <LOCATION_CODE> (589)
PTNCS

>  <AMOUNT_CURRENT> (589)
32.3

$$$$
WAY-385501
csChFnd80/10111816222D

 27 31  0  0  0  0  0  0  0  0999 V2000
    4.5792   -3.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  5  7  2  0  0  0  0
  6  3  1  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 18  1  0  0  0  0
 10  6  1  0  0  0  0
 11  9  2  0  0  0  0
 12  2  1  0  0  0  0
 13  5  1  0  0  0  0
 14  1  1  0  0  0  0
 15  3  2  0  0  0  0
 16  8  1  0  0  0  0
 17 16  2  0  0  0  0
 18 12  1  0  0  0  0
 19  6  2  0  0  0  0
 20 10  2  0  0  0  0
 21 14  1  0  0  0  0
 22 14  2  0  0  0  0
 23 19  1  0  0  0  0
 24 23  2  0  0  0  0
 25 22  1  0  0  0  0
 26 21  2  0  0  0  0
 27 25  2  0  0  0  0
  4 10  1  0  0  0  0
 27 26  1  0  0  0  0
 24 20  1  0  0  0  0
  5  8  1  0  0  0  0
 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (590)
590

>  <Formula> (590)
C20H14N4OS2

>  <MolWeight> (590)
390.48136

>  <PCAT_CMPD_ID> (590)
WAY-385501

>  <CNC_ID> (590)
359412491

>  <transfer_container_id> (590)
PTN000000073

>  <COMPOUND_NUMBER> (590)
WAY-385501

>  <BAR_CODE_NO> (590)
2547700

>  <LOCATION_CODE> (590)
PTNCS

>  <AMOUNT_CURRENT> (590)
29.6

$$$$
WAY-385569
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -6.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7 12  1  0  0  0  0
  8  6  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  1  0  0  0  0
 11  9  2  0  0  0  0
 12 16  1  0  0  0  0
 13  3  1  0  0  0  0
 14  7  2  0  0  0  0
 15 10  2  0  0  0  0
 16 10  1  0  0  0  0
 17  9  1  0  0  0  0
 18  4  2  0  0  0  0
 19 22  2  0  0  0  0
 20 13  2  0  0  0  0
 21 13  1  0  0  0  0
 22 18  1  0  0  0  0
 23 21  2  0  0  0  0
 24 20  1  0  0  0  0
 25 23  1  0  0  0  0
  8  3  2  0  0  0  0
 24 25  2  0  0  0  0
 11 19  1  0  0  0  0
M  END
>  <Mol_ID> (591)
591

>  <Formula> (591)
C17H12ClN3O3S

>  <MolWeight> (591)
373.81348

>  <PCAT_CMPD_ID> (591)
WAY-385569

>  <CNC_ID> (591)
359412525

>  <transfer_container_id> (591)
PTN000000073

>  <COMPOUND_NUMBER> (591)
WAY-385569

>  <BAR_CODE_NO> (591)
2547663

>  <LOCATION_CODE> (591)
PTNCS

>  <AMOUNT_CURRENT> (591)
32.5

$$$$
WAY-385602
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
    4.4042   -5.0417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 15  8  2  0  0  0  0
 16  7  1  0  0  0  0
 17  7  2  0  0  0  0
 18  5  1  0  0  0  0
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M  END
>  <Mol_ID> (592)
592

>  <Formula> (592)
C20H19ClFN3O3

>  <MolWeight> (592)
403.8345632

>  <PCAT_CMPD_ID> (592)
WAY-385602

>  <CNC_ID> (592)
359412652

>  <transfer_container_id> (592)
PTN000000073

>  <COMPOUND_NUMBER> (592)
WAY-385602

>  <BAR_CODE_NO> (592)
2547694

>  <LOCATION_CODE> (592)
PTNCS

>  <AMOUNT_CURRENT> (592)
32.9

$$$$
WAY-385619
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    1.7667   -9.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  7  1  0  0  0  0
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  6  4  2  0  0  0  0
  7  9  1  0  0  0  0
  8 13  1  0  0  0  0
  9  1  1  0  0  0  0
 10  1  2  0  0  0  0
 11  3  2  0  0  0  0
 12  4  1  0  0  0  0
 13 12  2  0  0  0  0
 14  5  1  0  0  0  0
 15  8  1  0  0  0  0
 16  2  1  0  0  0  0
 17  2  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 18 19  1  0  0  0  0
  5  8  2  0  0  0  0
M  END
>  <Mol_ID> (593)
593

>  <Formula> (593)
C13H15ClN2O3

>  <MolWeight> (593)
282.7228

>  <PCAT_CMPD_ID> (593)
WAY-385619

>  <CNC_ID> (593)
359412586

>  <transfer_container_id> (593)
PTN000000073

>  <COMPOUND_NUMBER> (593)
WAY-385619

>  <BAR_CODE_NO> (593)
2547678

>  <LOCATION_CODE> (593)
PTNCS

>  <AMOUNT_CURRENT> (593)
32.8

$$$$
WAY-385621
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   -3.7583   -6.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  9  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
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  8 14  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
 12  2  2  0  0  0  0
 13  4  1  0  0  0  0
 14 13  2  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 17 10  1  0  0  0  0
 18  3  1  0  0  0  0
 19 17  2  0  0  0  0
 20 17  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  2  0  0  0  0
 23 22  1  0  0  0  0
  5  8  2  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (594)
594

>  <Formula> (594)
C17H17ClN2O3

>  <MolWeight> (594)
332.78148

>  <PCAT_CMPD_ID> (594)
WAY-385621

>  <CNC_ID> (594)
359412588

>  <transfer_container_id> (594)
PTN000000073

>  <COMPOUND_NUMBER> (594)
WAY-385621

>  <BAR_CODE_NO> (594)
2547680

>  <LOCATION_CODE> (594)
PTNCS

>  <AMOUNT_CURRENT> (594)
32.5

$$$$
WAY-386328
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  1  0  0  0  0
 13  1  2  0  0  0  0
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 16 11  2  0  0  0  0
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 20 13  1  0  0  0  0
 21 19  1  0  0  0  0
 18  6  1  0  0  0  0
  9 14  2  0  0  0  0
M  END
>  <Mol_ID> (595)
595

>  <Formula> (595)
C16H14N2O3

>  <MolWeight> (595)
282.29396

>  <PCAT_CMPD_ID> (595)
WAY-386328

>  <CNC_ID> (595)
359413259

>  <transfer_container_id> (595)
PTN000000073

>  <COMPOUND_NUMBER> (595)
WAY-386328

>  <BAR_CODE_NO> (595)
2548393

>  <LOCATION_CODE> (595)
PTNCS

>  <AMOUNT_CURRENT> (595)
32.9

$$$$
WAY-386628
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
    3.2042    1.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  8  2  0  0  0  0
 11  1  1  0  0  0  0
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 13  8  1  0  0  0  0
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 18  3  1  0  0  0  0
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 21  6  1  0  0  0  0
 22  6  1  0  0  0  0
 23  6  1  0  0  0  0
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 30 20  1  0  0  0  0
  5  3  2  0  0  0  0
 29 20  2  0  0  0  0
  7 17  2  0  0  0  0
M  END
>  <Mol_ID> (596)
596

>  <Formula> (596)
C18H15ClF3N5OS2

>  <MolWeight> (596)
473.9228096

>  <PCAT_CMPD_ID> (596)
WAY-386628

>  <CNC_ID> (596)
359413369

>  <transfer_container_id> (596)
PTN000000073

>  <COMPOUND_NUMBER> (596)
WAY-386628

>  <BAR_CODE_NO> (596)
2548461

>  <LOCATION_CODE> (596)
PTNCS

>  <AMOUNT_CURRENT> (596)
32.6

$$$$
WAY-386687
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    1.1546    0.5065    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3371   -0.1060    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  2  2  0  0  0  0
 13  2  2  0  0  0  0
 14  3  2  0  0  0  0
 15  6  2  0  0  0  0
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 17 15  1  0  0  0  0
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 19  9  2  0  0  0  0
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 24  7  1  0  0  0  0
 25  7  1  0  0  0  0
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 28 25  1  0  0  0  0
 29 28  1  0  0  0  0
 19 21  1  0  0  0  0
 16  5  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
>  <Mol_ID> (597)
597

>  <Formula> (597)
C18H20Cl2N2O5S2

>  <MolWeight> (597)
479.3978

>  <PCAT_CMPD_ID> (597)
WAY-386687

>  <CNC_ID> (597)
359413428

>  <transfer_container_id> (597)
PTN000000073

>  <COMPOUND_NUMBER> (597)
WAY-386687

>  <BAR_CODE_NO> (597)
2548548

>  <LOCATION_CODE> (597)
PTNCS

>  <AMOUNT_CURRENT> (597)
32.5

$$$$
WAY-386728
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   12.6250   -1.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  2  0  0  0  0
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 10  9  1  0  0  0  0
 11  7  2  0  0  0  0
 12 14  1  0  0  0  0
 13  4  1  0  0  0  0
 14  7  1  0  0  0  0
 15  8  1  0  0  0  0
 16  9  1  0  0  0  0
 17 13  2  0  0  0  0
 18 13  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  2  0  0  0  0
 21 20  1  0  0  0  0
  6 11  1  0  0  0  0
 21 19  2  0  0  0  0
  8 10  2  0  0  0  0
M  END
>  <Mol_ID> (598)
598

>  <Formula> (598)
C14H12N4OS2

>  <MolWeight> (598)
316.40128

>  <PCAT_CMPD_ID> (598)
WAY-386728

>  <CNC_ID> (598)
359413468

>  <transfer_container_id> (598)
PTN000000073

>  <COMPOUND_NUMBER> (598)
WAY-386728

>  <BAR_CODE_NO> (598)
2548652

>  <LOCATION_CODE> (598)
PTNCS

>  <AMOUNT_CURRENT> (598)
28.8

$$$$
WAY-386854
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    8.4590    2.5470    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  2  0  0  0  0
 11  6  2  0  0  0  0
 12  2  1  0  0  0  0
 13  4  2  0  0  0  0
 14  6  1  0  0  0  0
 15 13  1  0  0  0  0
 16  7  2  0  0  0  0
 17  8  2  0  0  0  0
 18 15  2  0  0  0  0
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 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
  3  8  1  0  0  0  0
 17 20  1  0  0  0  0
 11 18  1  0  0  0  0
M  END
>  <Mol_ID> (599)
599

>  <Formula> (599)
C17H15NO2S

>  <MolWeight> (599)
297.3715

>  <PCAT_CMPD_ID> (599)
WAY-386854

>  <CNC_ID> (599)
359413589

>  <transfer_container_id> (599)
PTN000000073

>  <COMPOUND_NUMBER> (599)
WAY-386854

>  <BAR_CODE_NO> (599)
2548716

>  <LOCATION_CODE> (599)
PTNCS

>  <AMOUNT_CURRENT> (599)
32.9

$$$$
WAY-386933
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
   -1.2958    0.3833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  2  0  0  0  0
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 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
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 15 10  1  0  0  0  0
M  END
>  <Mol_ID> (600)
600

>  <Formula> (600)
C11H8ClNO2

>  <MolWeight> (600)
221.63972

>  <PCAT_CMPD_ID> (600)
WAY-386933

>  <CNC_ID> (600)
359413664

>  <transfer_container_id> (600)
PTN000000073

>  <COMPOUND_NUMBER> (600)
WAY-386933

>  <BAR_CODE_NO> (600)
2548962

>  <LOCATION_CODE> (600)
PTNCS

>  <AMOUNT_CURRENT> (600)
29.5

$$$$
WAY-386970
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
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 13 10  1  0  0  0  0
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 16  5  2  0  0  0  0
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 18  8  1  0  0  0  0
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 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (601)
601

>  <Formula> (601)
C16H12N4O2S

>  <MolWeight> (601)
324.35708

>  <PCAT_CMPD_ID> (601)
WAY-386970

>  <CNC_ID> (601)
359413701

>  <transfer_container_id> (601)
PTN000000073

>  <COMPOUND_NUMBER> (601)
WAY-386970

>  <BAR_CODE_NO> (601)
2548874

>  <LOCATION_CODE> (601)
PTNCS

>  <AMOUNT_CURRENT> (601)
32.8

$$$$
WAY-387949
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  6  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  8  1  0  0  0  0
 15  1  1  0  0  0  0
 16 14  1  0  0  0  0
 17  5  2  0  0  0  0
 18  8  2  0  0  0  0
 19  3  1  0  0  0  0
 20  4  1  0  0  0  0
 21  6  1  0  0  0  0
 22  7  1  0  0  0  0
 23 24  1  0  0  0  0
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 25 15  1  0  0  0  0
 26 20  2  0  0  0  0
 27 26  1  0  0  0  0
 10 23  2  0  0  0  0
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 27 22  2  0  0  0  0
M  END
>  <Mol_ID> (602)
602

>  <Formula> (602)
C19H20N2O5S

>  <MolWeight> (602)
388.4375

>  <PCAT_CMPD_ID> (602)
WAY-387949

>  <CNC_ID> (602)
359414006

>  <transfer_container_id> (602)
PTN000000073

>  <COMPOUND_NUMBER> (602)
WAY-387949

>  <BAR_CODE_NO> (602)
2549869

>  <LOCATION_CODE> (602)
PTNCS

>  <AMOUNT_CURRENT> (602)
33

$$$$
WAY-387989
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
    4.4566   -0.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
 15 16  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (603)
603

>  <Formula> (603)
C15H12N4S

>  <MolWeight> (603)
280.34758

>  <PCAT_CMPD_ID> (603)
WAY-387989

>  <CNC_ID> (603)
359414043

>  <transfer_container_id> (603)
PTN000000073

>  <COMPOUND_NUMBER> (603)
WAY-387989

>  <BAR_CODE_NO> (603)
2550144

>  <LOCATION_CODE> (603)
PTNCS

>  <AMOUNT_CURRENT> (603)
32.3

$$$$
WAY-388129
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   11.6917   -5.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2417   -4.2042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.6917   -6.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2417   -2.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  1  0  0  0  0
 11  4  2  0  0  0  0
 12 11  1  0  0  0  0
 13  9  1  0  0  0  0
 14  5  2  0  0  0  0
 15 10  2  0  0  0  0
 16 13  1  0  0  0  0
 17 16  2  0  0  0  0
 18 10  1  0  0  0  0
 19  3  1  0  0  0  0
 20 17  1  0  0  0  0
 21 13  2  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 24 18  1  0  0  0  0
  7  5  1  0  0  0  0
 12  9  2  0  0  0  0
 17 23  1  0  0  0  0
M  END
>  <Mol_ID> (604)
604

>  <Formula> (604)
C17H15ClN2O3S

>  <MolWeight> (604)
362.8306

>  <PCAT_CMPD_ID> (604)
WAY-388129

>  <CNC_ID> (604)
359414180

>  <transfer_container_id> (604)
PTN000000073

>  <COMPOUND_NUMBER> (604)
WAY-388129

>  <BAR_CODE_NO> (604)
2550088

>  <LOCATION_CODE> (604)
PTNCS

>  <AMOUNT_CURRENT> (604)
32.2

$$$$
WAY-388141
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.9747    4.1200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0622    7.7562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802    4.1200    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
 11  7  2  0  0  0  0
 12  5  1  0  0  0  0
 13  5  2  0  0  0  0
 14  6  2  0  0  0  0
 15  7  1  0  0  0  0
 16  2  2  0  0  0  0
 17  3  1  0  0  0  0
 18  4  1  0  0  0  0
 19  8  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 22 18  2  0  0  0  0
 23 22  1  0  0  0  0
  8  9  1  0  0  0  0
 23 19  2  0  0  0  0
 11 20  1  0  0  0  0
M  END
>  <Mol_ID> (605)
605

>  <Formula> (605)
C17H15ClN2O3

>  <MolWeight> (605)
330.7656

>  <PCAT_CMPD_ID> (605)
WAY-388141

>  <CNC_ID> (605)
359414192

>  <transfer_container_id> (605)
PTN000000073

>  <COMPOUND_NUMBER> (605)
WAY-388141

>  <BAR_CODE_NO> (605)
2550100

>  <LOCATION_CODE> (605)
PTNCS

>  <AMOUNT_CURRENT> (605)
32.1

$$$$
WAY-388156
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    3.7000    0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  0  0  0  0
 13 11  2  0  0  0  0
 14 10  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  2  0  0  0  0
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  4  5  1  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (606)
606

>  <Formula> (606)
C12H15N5O

>  <MolWeight> (606)
245.2804

>  <PCAT_CMPD_ID> (606)
WAY-388156

>  <CNC_ID> (606)
359414207

>  <transfer_container_id> (606)
PTN000000073

>  <COMPOUND_NUMBER> (606)
WAY-388156

>  <BAR_CODE_NO> (606)
2549914

>  <LOCATION_CODE> (606)
PTNCS

>  <AMOUNT_CURRENT> (606)
32.7

$$$$
CL-255413
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
   -1.4304    0.3464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4304    1.7016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (607)
607

>  <Formula> (607)
C12H11N5

>  <MolWeight> (607)
225.24924

>  <PCAT_CMPD_ID> (607)
CL-255413

>  <CNC_ID> (607)
359419962

>  <transfer_container_id> (607)
PTN000000074

>  <COMPOUND_NUMBER> (607)
CL-255413

>  <BAR_CODE_NO> (607)
3911649

>  <LOCATION_CODE> (607)
PTNCS

>  <AMOUNT_CURRENT> (607)
33.9

$$$$
CL-408960
csChFnd80/10111816222D

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 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (608)
608

>  <Formula> (608)
C17H13ClN2O2S

>  <MolWeight> (608)
344.81532

>  <PCAT_CMPD_ID> (608)
CL-408960

>  <CNC_ID> (608)
359419994

>  <transfer_container_id> (608)
PTN000000074

>  <COMPOUND_NUMBER> (608)
CL-408960

>  <BAR_CODE_NO> (608)
3912236

>  <LOCATION_CODE> (608)
PTNCS

>  <AMOUNT_CURRENT> (608)
33.3

$$$$
CL-414988
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 13 18  2  0  0  0  0
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 16 20  2  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
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 17 20  1  0  0  0  0
 19 21  2  0  0  0  0
M  END
>  <Mol_ID> (609)
609

>  <Formula> (609)
C16H11FN2O2S

>  <MolWeight> (609)
314.3341432

>  <PCAT_CMPD_ID> (609)
CL-414988

>  <CNC_ID> (609)
359420000

>  <transfer_container_id> (609)
PTN000000074

>  <COMPOUND_NUMBER> (609)
CL-414988

>  <BAR_CODE_NO> (609)
3912237

>  <LOCATION_CODE> (609)
PTNCS

>  <AMOUNT_CURRENT> (609)
33.2

$$$$
WAY-250605
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11 16  2  0  0  0  0
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 17 20  2  0  0  0  0
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 13 16  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (610)
610

>  <Formula> (610)
C14H8Cl2N2OS

>  <MolWeight> (610)
323.19712

>  <PCAT_CMPD_ID> (610)
WAY-250605

>  <CNC_ID> (610)
359420328

>  <transfer_container_id> (610)
PTN000000074

>  <COMPOUND_NUMBER> (610)
WAY-250605

>  <BAR_CODE_NO> (610)
3912369

>  <LOCATION_CODE> (610)
PTNCS

>  <AMOUNT_CURRENT> (610)
33

$$$$
WAY-307518
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (611)
611

>  <Formula> (611)
C23H23N3O2

>  <MolWeight> (611)
373.44762

>  <PCAT_CMPD_ID> (611)
WAY-307518

>  <CNC_ID> (611)
359420374

>  <transfer_container_id> (611)
PTN000000074

>  <COMPOUND_NUMBER> (611)
WAY-307518

>  <BAR_CODE_NO> (611)
3911316

>  <LOCATION_CODE> (611)
PTNCS

>  <AMOUNT_CURRENT> (611)
33.4

$$$$
WAY-308264
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (612)
612

>  <Formula> (612)
C14H14N4O2S

>  <MolWeight> (612)
302.35156

>  <PCAT_CMPD_ID> (612)
WAY-308264

>  <CNC_ID> (612)
359421118

>  <transfer_container_id> (612)
PTN000000074

>  <COMPOUND_NUMBER> (612)
WAY-308264

>  <BAR_CODE_NO> (612)
3912199

>  <LOCATION_CODE> (612)
PTNCS

>  <AMOUNT_CURRENT> (612)
33

$$$$
WAY-308280
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 11  1  0  0  0  0
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 18 19  1  0  0  0  0
  6  8  1  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (613)
613

>  <Formula> (613)
C13H16N4OS

>  <MolWeight> (613)
276.35734

>  <PCAT_CMPD_ID> (613)
WAY-308280

>  <CNC_ID> (613)
359421134

>  <transfer_container_id> (613)
PTN000000074

>  <COMPOUND_NUMBER> (613)
WAY-308280

>  <BAR_CODE_NO> (613)
3912215

>  <LOCATION_CODE> (613)
PTNCS

>  <AMOUNT_CURRENT> (613)
33.7

$$$$
WAY-308981
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   -1.1276    0.8310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
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  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  3  0  0  0  0
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 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  2  0  0  0  0
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 16 20  1  0  0  0  0
 18 21  1  0  0  0  0
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 20 24  2  0  0  0  0
 21 25  2  0  0  0  0
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 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 28 30  1  0  0  0  0
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 14 17  2  0  0  0  0
 22 25  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (614)
614

>  <Formula> (614)
C24H21N3O2S

>  <MolWeight> (614)
415.50744

>  <PCAT_CMPD_ID> (614)
WAY-308981

>  <CNC_ID> (614)
359421834

>  <transfer_container_id> (614)
PTN000000074

>  <COMPOUND_NUMBER> (614)
WAY-308981

>  <BAR_CODE_NO> (614)
3913006

>  <LOCATION_CODE> (614)
PTNCS

>  <AMOUNT_CURRENT> (614)
33.5

$$$$
WAY-309125
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.9793   -1.6133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  4  9  2  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 16 19  2  0  0  0  0
 17 20  2  0  0  0  0
 19 21  1  0  0  0  0
  5  7  2  0  0  0  0
  9 10  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (615)
615

>  <Formula> (615)
C17H19N3O

>  <MolWeight> (615)
281.35226

>  <PCAT_CMPD_ID> (615)
WAY-309125

>  <CNC_ID> (615)
359421977

>  <transfer_container_id> (615)
PTN000000074

>  <COMPOUND_NUMBER> (615)
WAY-309125

>  <BAR_CODE_NO> (615)
3913181

>  <LOCATION_CODE> (615)
PTNCS

>  <AMOUNT_CURRENT> (615)
33.9

$$$$
WAY-309149
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  1  3  1  0  0  0  0
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  5 10  2  0  0  0  0
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 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 13 15  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  6 10  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (616)
616

>  <Formula> (616)
C14H21N3O4S

>  <MolWeight> (616)
327.39924

>  <PCAT_CMPD_ID> (616)
WAY-309149

>  <CNC_ID> (616)
359422001

>  <transfer_container_id> (616)
PTN000000074

>  <COMPOUND_NUMBER> (616)
WAY-309149

>  <BAR_CODE_NO> (616)
3913208

>  <LOCATION_CODE> (616)
PTNCS

>  <AMOUNT_CURRENT> (616)
33.9

$$$$
WAY-309233-A
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
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 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
  7 12  2  0  0  0  0
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 15 17  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (617)
617

>  <Formula> (617)
C18H18N4O2

>  <MolWeight> (617)
322.36112

>  <PCAT_CMPD_ID> (617)
WAY-309233-A

>  <CNC_ID> (617)
359422085

>  <transfer_container_id> (617)
PTN000000074

>  <COMPOUND_NUMBER> (617)
WAY-309233-A

>  <BAR_CODE_NO> (617)
3913313

>  <LOCATION_CODE> (617)
PTNCS

>  <AMOUNT_CURRENT> (617)
33.6

$$$$
WAY-309457
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    1.4988    0.0812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (618)
618

>  <Formula> (618)
C17H25N3O2

>  <MolWeight> (618)
303.3993

>  <PCAT_CMPD_ID> (618)
WAY-309457

>  <CNC_ID> (618)
359422309

>  <transfer_container_id> (618)
PTN000000074

>  <COMPOUND_NUMBER> (618)
WAY-309457

>  <BAR_CODE_NO> (618)
3913571

>  <LOCATION_CODE> (618)
PTNCS

>  <AMOUNT_CURRENT> (618)
33.9

$$$$
WAY-309615
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  8  2  0  0  0  0
 12  4  2  0  0  0  0
 13 11  1  0  0  0  0
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 15 14  2  0  0  0  0
 16 13  1  0  0  0  0
 10  5  1  0  0  0  0
 11 15  1  0  0  0  0
M  END
>  <Mol_ID> (619)
619

>  <Formula> (619)
C11H11NO2S2

>  <MolWeight> (619)
253.34054

>  <PCAT_CMPD_ID> (619)
WAY-309615

>  <CNC_ID> (619)
359422467

>  <transfer_container_id> (619)
PTN000000074

>  <COMPOUND_NUMBER> (619)
WAY-309615

>  <BAR_CODE_NO> (619)
3913754

>  <LOCATION_CODE> (619)
PTNCS

>  <AMOUNT_CURRENT> (619)
33.5

$$$$
WAY-340177
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   13.0042   -4.1292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 13  7  2  0  0  0  0
 14  8  2  0  0  0  0
 15  4  1  0  0  0  0
 16  8  1  0  0  0  0
 17  6  1  0  0  0  0
 18  7  1  0  0  0  0
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 20 21  1  0  0  0  0
 21 19  2  0  0  0  0
  3  4  1  0  0  0  0
 12  9  2  0  0  0  0
 17 20  2  0  0  0  0
M  END
>  <Mol_ID> (620)
620

>  <Formula> (620)
C16H14N2O2S

>  <MolWeight> (620)
298.35956

>  <PCAT_CMPD_ID> (620)
WAY-340177

>  <CNC_ID> (620)
359425313

>  <transfer_container_id> (620)
PTN000000074

>  <COMPOUND_NUMBER> (620)
WAY-340177

>  <BAR_CODE_NO> (620)
2550550

>  <LOCATION_CODE> (620)
PTNCS

>  <AMOUNT_CURRENT> (620)
32.3

$$$$
WAY-340664
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (621)
621

>  <Formula> (621)
C16H17NOS

>  <MolWeight> (621)
271.37728

>  <PCAT_CMPD_ID> (621)
WAY-340664

>  <CNC_ID> (621)
359425673

>  <transfer_container_id> (621)
PTN000000074

>  <COMPOUND_NUMBER> (621)
WAY-340664

>  <BAR_CODE_NO> (621)
2550763

>  <LOCATION_CODE> (621)
PTNCS

>  <AMOUNT_CURRENT> (621)
32.4

$$$$
WAY-340669
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 16 18  1  0  0  0  0
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 10 12  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (622)
622

>  <Formula> (622)
C15H18N2S

>  <MolWeight> (622)
258.38182

>  <PCAT_CMPD_ID> (622)
WAY-340669

>  <CNC_ID> (622)
359425678

>  <transfer_container_id> (622)
PTN000000074

>  <COMPOUND_NUMBER> (622)
WAY-340669

>  <BAR_CODE_NO> (622)
2550767

>  <LOCATION_CODE> (622)
PTNCS

>  <AMOUNT_CURRENT> (622)
32.9

$$$$
WAY-340752
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
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 11 18  1  0  0  0  0
M  END
>  <Mol_ID> (623)
623

>  <Formula> (623)
C15H18BrNO6

>  <MolWeight> (623)
388.21052

>  <PCAT_CMPD_ID> (623)
WAY-340752

>  <CNC_ID> (623)
359425756

>  <transfer_container_id> (623)
PTN000000074

>  <COMPOUND_NUMBER> (623)
WAY-340752

>  <BAR_CODE_NO> (623)
2550697

>  <LOCATION_CODE> (623)
PTNCS

>  <AMOUNT_CURRENT> (623)
32.8

$$$$
WAY-340818
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 18  6  2  0  0  0  0
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 20  8  2  0  0  0  0
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 28 23  2  0  0  0  0
 29 22  1  0  0  0  0
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 29 30  2  0  0  0  0
 26 20  1  0  0  0  0
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 27 21  1  0  0  0  0
M  END
>  <Mol_ID> (624)
624

>  <Formula> (624)
C24H17N3O2S

>  <MolWeight> (624)
411.47568

>  <PCAT_CMPD_ID> (624)
WAY-340818

>  <CNC_ID> (624)
359425821

>  <transfer_container_id> (624)
PTN000000074

>  <COMPOUND_NUMBER> (624)
WAY-340818

>  <BAR_CODE_NO> (624)
2550789

>  <LOCATION_CODE> (624)
PTNCS

>  <AMOUNT_CURRENT> (624)
32.2

$$$$
WAY-340424
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
    1.7417   -9.8667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10 12  1  0  0  0  0
 11  3  1  0  0  0  0
 12  5  1  0  0  0  0
 13 10  1  0  0  0  0
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 20  2  1  0  0  0  0
 21 20  1  0  0  0  0
 22  4  1  0  0  0  0
 23 21  1  0  0  0  0
 24  9  1  0  0  0  0
  9 23  1  0  0  0  0
 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (625)
625

>  <Formula> (625)
C18H24ClNO4

>  <MolWeight> (625)
353.84046

>  <PCAT_CMPD_ID> (625)
WAY-340424

>  <CNC_ID> (625)
359425447

>  <transfer_container_id> (625)
PTN000000074

>  <COMPOUND_NUMBER> (625)
WAY-340424

>  <BAR_CODE_NO> (625)
2550414

>  <LOCATION_CODE> (625)
PTNCS

>  <AMOUNT_CURRENT> (625)
29.6

$$$$
WAY-340560
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  4  2  0  0  0  0
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 13  6  1  0  0  0  0
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 17 15  1  0  0  0  0
 18 17  1  0  0  0  0
  8 10  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (626)
626

>  <Formula> (626)
C13H17NO3S

>  <MolWeight> (626)
267.34398

>  <PCAT_CMPD_ID> (626)
WAY-340560

>  <CNC_ID> (626)
359425560

>  <transfer_container_id> (626)
PTN000000074

>  <COMPOUND_NUMBER> (626)
WAY-340560

>  <BAR_CODE_NO> (626)
2550560

>  <LOCATION_CODE> (626)
PTNCS

>  <AMOUNT_CURRENT> (626)
32.8

$$$$
WAY-340619
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.2000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  1  0  0  0  0
 11  5  1  0  0  0  0
 12 16  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  2  0  0  0  0
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 22 18  2  0  0  0  0
 10 11  2  0  0  0  0
  9  6  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (627)
627

>  <Formula> (627)
C15H12N2O3S2

>  <MolWeight> (627)
332.39738

>  <PCAT_CMPD_ID> (627)
WAY-340619

>  <CNC_ID> (627)
359425629

>  <transfer_container_id> (627)
PTN000000074

>  <COMPOUND_NUMBER> (627)
WAY-340619

>  <BAR_CODE_NO> (627)
2550613

>  <LOCATION_CODE> (627)
PTNCS

>  <AMOUNT_CURRENT> (627)
33

$$$$
WAY-341003
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (628)
628

>  <Formula> (628)
C17H13ClN2O3S

>  <MolWeight> (628)
360.81472

>  <PCAT_CMPD_ID> (628)
WAY-341003

>  <CNC_ID> (628)
359426002

>  <transfer_container_id> (628)
PTN000000074

>  <COMPOUND_NUMBER> (628)
WAY-341003

>  <BAR_CODE_NO> (628)
2551007

>  <LOCATION_CODE> (628)
PTNCS

>  <AMOUNT_CURRENT> (628)
32.4

$$$$
WAY-341072
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    4.3792   -4.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  4  1  0  0  0  0
  8  2  1  0  0  0  0
  9  8  1  0  0  0  0
 10 12  1  0  0  0  0
 11  7  2  0  0  0  0
 12  4  2  0  0  0  0
 13  9  1  0  0  0  0
 14 16  1  0  0  0  0
 15  9  2  0  0  0  0
 16 21  2  0  0  0  0
 17 20  1  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 20 18  2  0  0  0  0
 21 18  1  0  0  0  0
 22  5  1  0  0  0  0
 23  6  1  0  0  0  0
 24 19  1  0  0  0  0
 25 19  1  0  0  0  0
 26 22  2  0  0  0  0
 27 23  2  0  0  0  0
  5  6  2  0  0  0  0
 10 11  1  0  0  0  0
 26 27  1  0  0  0  0
 17 14  2  0  0  0  0
M  END
>  <Mol_ID> (629)
629

>  <Formula> (629)
C21H20N4OS

>  <MolWeight> (629)
376.4747

>  <PCAT_CMPD_ID> (629)
WAY-341072

>  <CNC_ID> (629)
359426070

>  <transfer_container_id> (629)
PTN000000074

>  <COMPOUND_NUMBER> (629)
WAY-341072

>  <BAR_CODE_NO> (629)
2551308

>  <LOCATION_CODE> (629)
PTNCS

>  <AMOUNT_CURRENT> (629)
33

$$$$
WAY-341327
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    3.7045    8.4909    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2417    7.0835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6 11  2  0  0  0  0
  7  4  2  0  0  0  0
  8  3  1  0  0  0  0
  9 14  2  0  0  0  0
 10  2  2  0  0  0  0
 11 13  1  0  0  0  0
 12  5  1  0  0  0  0
 13  7  1  0  0  0  0
 14 15  1  0  0  0  0
 15 13  2  0  0  0  0
 16  6  1  0  0  0  0
 17  9  1  0  0  0  0
 18  3  2  0  0  0  0
 19  8  2  0  0  0  0
 20 16  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 22  2  0  0  0  0
 12  8  1  0  0  0  0
 19 23  1  0  0  0  0
  9  6  1  0  0  0  0
M  END
>  <Mol_ID> (630)
630

>  <Formula> (630)
C19H19NO3

>  <MolWeight> (630)
309.35906

>  <PCAT_CMPD_ID> (630)
WAY-341327

>  <CNC_ID> (630)
359426318

>  <transfer_container_id> (630)
PTN000000074

>  <COMPOUND_NUMBER> (630)
WAY-341327

>  <BAR_CODE_NO> (630)
2551357

>  <LOCATION_CODE> (630)
PTNCS

>  <AMOUNT_CURRENT> (630)
32.6

$$$$
WAY-341352
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
    4.2417   -4.0167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  2  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12 17  1  0  0  0  0
 13 11  2  0  0  0  0
 14  3  1  0  0  0  0
 15 10  2  0  0  0  0
 16  7  2  0  0  0  0
 17 14  2  0  0  0  0
 18 19  1  0  0  0  0
 19 10  1  0  0  0  0
 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
 22 18  1  0  0  0  0
 23 11  1  0  0  0  0
 24 12  1  0  0  0  0
 25 20  1  0  0  0  0
 26 22  2  0  0  0  0
 27 22  1  0  0  0  0
 28 26  1  0  0  0  0
 29 27  2  0  0  0  0
 30 29  1  0  0  0  0
 12  4  2  0  0  0  0
 20 13  1  0  0  0  0
 30 28  2  0  0  0  0
M  END
>  <Mol_ID> (631)
631

>  <Formula> (631)
C23H24N2O4S

>  <MolWeight> (631)
424.51266

>  <PCAT_CMPD_ID> (631)
WAY-341352

>  <CNC_ID> (631)
359426343

>  <transfer_container_id> (631)
PTN000000074

>  <COMPOUND_NUMBER> (631)
WAY-341352

>  <BAR_CODE_NO> (631)
2551863

>  <LOCATION_CODE> (631)
PTNCS

>  <AMOUNT_CURRENT> (631)
32.9

$$$$
WAY-341384
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    5.3292   -4.1167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  2  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
 15 13  1  0  0  0  0
 16 13  2  0  0  0  0
 17 19  2  0  0  0  0
 18 15  2  0  0  0  0
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 20 17  1  0  0  0  0
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 22 11  1  0  0  0  0
 23 12  1  0  0  0  0
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 26 22  2  0  0  0  0
 10  7  1  0  0  0  0
 12 11  2  0  0  0  0
 26 25  1  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (632)
632

>  <Formula> (632)
C19H17N5O2

>  <MolWeight> (632)
347.37058

>  <PCAT_CMPD_ID> (632)
WAY-341384

>  <CNC_ID> (632)
359426374

>  <transfer_container_id> (632)
PTN000000074

>  <COMPOUND_NUMBER> (632)
WAY-341384

>  <BAR_CODE_NO> (632)
2551997

>  <LOCATION_CODE> (632)
PTNCS

>  <AMOUNT_CURRENT> (632)
22.6

$$$$
WAY-341402
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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    6.6875   -1.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3125   -1.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8167   -1.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5042   -1.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  8  3  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12  5  2  0  0  0  0
 13  4  1  0  0  0  0
 14  6  1  0  0  0  0
 15 10  2  0  0  0  0
 16 11  2  0  0  0  0
 17  9  2  0  0  0  0
 18 20  2  0  0  0  0
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 23 13  1  0  0  0  0
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 26 23  2  0  0  0  0
  7 12  1  0  0  0  0
 13 14  2  0  0  0  0
 25 26  1  0  0  0  0
 18 16  1  0  0  0  0
M  END
>  <Mol_ID> (633)
633

>  <Formula> (633)
C18H13F2N5O

>  <MolWeight> (633)
353.3255264

>  <PCAT_CMPD_ID> (633)
WAY-341402

>  <CNC_ID> (633)
359426392

>  <transfer_container_id> (633)
PTN000000074

>  <COMPOUND_NUMBER> (633)
WAY-341402

>  <BAR_CODE_NO> (633)
2552378

>  <LOCATION_CODE> (633)
PTNCS

>  <AMOUNT_CURRENT> (633)
29.3

$$$$
WAY-341447
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
   11.3667   -8.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4792   -9.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2875  -11.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5250  -10.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0167   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4500   -7.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3292   -7.7042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6667   -8.7917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.2250   -7.7917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  2  2  0  0  0  0
 11  9  1  0  0  0  0
 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
 14  3  1  0  0  0  0
 15  7  1  0  0  0  0
 16 20  1  0  0  0  0
 17 15  2  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  2  0  0  0  0
 21 16  1  0  0  0  0
 22 21  1  0  0  0  0
  8 13  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  1  0  0  0  0
 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (634)
634

>  <Formula> (634)
C18H21ClO3

>  <MolWeight> (634)
320.81054

>  <PCAT_CMPD_ID> (634)
WAY-341447

>  <CNC_ID> (634)
359426413

>  <transfer_container_id> (634)
PTN000000074

>  <COMPOUND_NUMBER> (634)
WAY-341447

>  <BAR_CODE_NO> (634)
2551381

>  <LOCATION_CODE> (634)
PTNCS

>  <AMOUNT_CURRENT> (634)
32.4

$$$$
WAY-341519
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    6.5875   -4.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6667   -4.8542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0042   -5.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3292   -4.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8000   -1.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  2  0  0  0  0
  3  4  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  8  1  0  0  0  0
  8 14  2  0  0  0  0
  9 10  2  0  0  0  0
 10 12  1  0  0  0  0
 11  6  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  2  0  0  0  0
 14 15  1  0  0  0  0
 15 12  2  0  0  0  0
 16  7  1  0  0  0  0
 17 10  1  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20 17  1  0  0  0  0
  3  2  1  0  0  0  0
  9  8  1  0  0  0  0
M  END
>  <Mol_ID> (635)
635

>  <Formula> (635)
C14H15NO5

>  <MolWeight> (635)
277.2726

>  <PCAT_CMPD_ID> (635)
WAY-341519

>  <CNC_ID> (635)
359426479

>  <transfer_container_id> (635)
PTN000000074

>  <COMPOUND_NUMBER> (635)
WAY-341519

>  <BAR_CODE_NO> (635)
2551567

>  <LOCATION_CODE> (635)
PTNCS

>  <AMOUNT_CURRENT> (635)
32.8

$$$$
WAY-341643
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    8.4542   -9.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1417   -7.9375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5042  -10.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5125   -7.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1917   -9.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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  5  1  1  0  0  0  0
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  7  2  1  0  0  0  0
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 10  6  1  0  0  0  0
 11 13  3  0  0  0  0
 12 10  1  0  0  0  0
 13 21  1  0  0  0  0
 14 12  1  0  0  0  0
 15 10  2  0  0  0  0
 16  9  2  0  0  0  0
 17 15  1  0  0  0  0
 18  9  1  0  0  0  0
 19  3  1  0  0  0  0
 20  5  1  0  0  0  0
 21 18  1  0  0  0  0
 22  8  2  0  0  0  0
 23 20  1  0  0  0  0
 24  7  2  0  0  0  0
 25 22  1  0  0  0  0
 26 24  1  0  0  0  0
 23 19  1  0  0  0  0
  8  7  1  0  0  0  0
 25 26  2  0  0  0  0
 14 17  2  0  0  0  0
M  END
>  <Mol_ID> (636)
636

>  <Formula> (636)
C21H16N2O2S

>  <MolWeight> (636)
360.42894

>  <PCAT_CMPD_ID> (636)
WAY-341643

>  <CNC_ID> (636)
359426596

>  <transfer_container_id> (636)
PTN000000074

>  <COMPOUND_NUMBER> (636)
WAY-341643

>  <BAR_CODE_NO> (636)
2551585

>  <LOCATION_CODE> (636)
PTNCS

>  <AMOUNT_CURRENT> (636)
32.3

$$$$
WAY-341644
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   12.3292   -5.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.2042   -6.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5 11  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  4  2  0  0  0  0
  9  5  2  0  0  0  0
 10  3  1  0  0  0  0
 11 13  1  0  0  0  0
 12  7  1  0  0  0  0
 13  4  1  0  0  0  0
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 15 14  1  0  0  0  0
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 17 12  2  0  0  0  0
 18 16  2  0  0  0  0
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 20  1  1  0  0  0  0
 21  3  1  0  0  0  0
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 21 25  2  0  0  0  0
 26 28  2  0  0  0  0
 18 14  1  0  0  0  0
M  END
>  <Mol_ID> (637)
637

>  <Formula> (637)
C23H18FNO3

>  <MolWeight> (637)
375.3923232

>  <PCAT_CMPD_ID> (637)
WAY-341644

>  <CNC_ID> (637)
359426597

>  <transfer_container_id> (637)
PTN000000074

>  <COMPOUND_NUMBER> (637)
WAY-341644

>  <BAR_CODE_NO> (637)
2551586

>  <LOCATION_CODE> (637)
PTNCS

>  <AMOUNT_CURRENT> (637)
32.2

$$$$
WAY-341659
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 13  5  1  0  0  0  0
 14  6  1  0  0  0  0
 15  7  2  0  0  0  0
 16  7  1  0  0  0  0
 17 10  1  0  0  0  0
 18 12  1  0  0  0  0
 19 11  1  0  0  0  0
 20  8  1  0  0  0  0
 21  9  1  0  0  0  0
 22 13  2  0  0  0  0
 23 14  2  0  0  0  0
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 25 18  1  0  0  0  0
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 27 20  2  0  0  0  0
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 29 22  1  0  0  0  0
 30 23  1  0  0  0  0
  9  4  1  0  0  0  0
 13 14  1  0  0  0  0
 28 21  2  0  0  0  0
 11 10  2  0  0  0  0
 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (638)
638

>  <Formula> (638)
C24H21N3O3

>  <MolWeight> (638)
399.44184

>  <PCAT_CMPD_ID> (638)
WAY-341659

>  <CNC_ID> (638)
359426612

>  <transfer_container_id> (638)
PTN000000074

>  <COMPOUND_NUMBER> (638)
WAY-341659

>  <BAR_CODE_NO> (638)
2551723

>  <LOCATION_CODE> (638)
PTNCS

>  <AMOUNT_CURRENT> (638)
29

$$$$
WAY-341684
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
    7.8000   -3.7167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6792   -6.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  2  2  0  0  0  0
  6 11  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  2  0  0  0  0
  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  4  2  0  0  0  0
 13  3  1  0  0  0  0
 14  9  2  0  0  0  0
 15 10  1  0  0  0  0
 16 10  2  0  0  0  0
 17 14  1  0  0  0  0
 18 20  2  0  0  0  0
 19 26  1  0  0  0  0
 20 16  1  0  0  0  0
 21 15  2  0  0  0  0
 22 18  1  0  0  0  0
 23  9  1  0  0  0  0
 24 13  2  0  0  0  0
 25 13  1  0  0  0  0
 26 25  2  0  0  0  0
 27 24  1  0  0  0  0
 28 19  1  0  0  0  0
 29 23  1  0  0  0  0
 30 28  1  0  0  0  0
 27 19  2  0  0  0  0
 11 17  2  0  0  0  0
 21 18  1  0  0  0  0
M  END
>  <Mol_ID> (639)
639

>  <Formula> (639)
C21H19FN2O5S

>  <MolWeight> (639)
430.4493632

>  <PCAT_CMPD_ID> (639)
WAY-341684

>  <CNC_ID> (639)
359426635

>  <transfer_container_id> (639)
PTN000000074

>  <COMPOUND_NUMBER> (639)
WAY-341684

>  <BAR_CODE_NO> (639)
2551685

>  <LOCATION_CODE> (639)
PTNCS

>  <AMOUNT_CURRENT> (639)
32.9

$$$$
WAY-341700
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
    5.5167   -3.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  2  0  0  0  0
  7 18  1  0  0  0  0
  8  7  1  0  0  0  0
  9  1  1  0  0  0  0
 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 13  1  0  0  0  0
 15  2  1  0  0  0  0
 16 13  2  0  0  0  0
 17 14  1  0  0  0  0
 18 12  1  0  0  0  0
 19 16  1  0  0  0  0
 20 10  2  0  0  0  0
 21 11  2  0  0  0  0
 22 15  2  0  0  0  0
 23 15  1  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 26 23  2  0  0  0  0
 27 22  1  0  0  0  0
 28 26  1  0  0  0  0
  5  3  1  0  0  0  0
 17 19  2  0  0  0  0
 27 28  2  0  0  0  0
 10 11  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (640)
640

>  <Formula> (640)
C21H17N5OS

>  <MolWeight> (640)
387.45758

>  <PCAT_CMPD_ID> (640)
WAY-341700

>  <CNC_ID> (640)
359426650

>  <transfer_container_id> (640)
PTN000000074

>  <COMPOUND_NUMBER> (640)
WAY-341700

>  <BAR_CODE_NO> (640)
2551817

>  <LOCATION_CODE> (640)
PTNCS

>  <AMOUNT_CURRENT> (640)
32.9

$$$$
WAY-341882
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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   10.3625   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -8.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13 21  1  0  0  0  0
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 16  7  1  0  0  0  0
 17  7  2  0  0  0  0
 18 15  1  0  0  0  0
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 23  6  1  0  0  0  0
 24  5  2  0  0  0  0
 25  4  2  0  0  0  0
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  4  5  1  0  0  0  0
 10 26  2  0  0  0  0
 32 31  2  0  0  0  0
 21 30  1  0  0  0  0
M  END
>  <Mol_ID> (641)
641

>  <Formula> (641)
C24H15N3O5

>  <MolWeight> (641)
425.393

>  <PCAT_CMPD_ID> (641)
WAY-341882

>  <CNC_ID> (641)
359426822

>  <transfer_container_id> (641)
PTN000000074

>  <COMPOUND_NUMBER> (641)
WAY-341882

>  <BAR_CODE_NO> (641)
2551883

>  <LOCATION_CODE> (641)
PTNCS

>  <AMOUNT_CURRENT> (641)
32.3

$$$$
WAY-345727
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   11.1375   -9.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3375   -9.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  7  2  2  0  0  0  0
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 10  1  2  0  0  0  0
 11 19  1  0  0  0  0
 12  3  1  0  0  0  0
 13  3  1  0  0  0  0
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 15 12  1  0  0  0  0
 16 13  1  0  0  0  0
 17  5  1  0  0  0  0
 18  6  1  0  0  0  0
 19  9  1  0  0  0  0
 20 14  1  0  0  0  0
 21  4  1  0  0  0  0
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 23 18  1  0  0  0  0
 24 20  1  0  0  0  0
 25 20  2  0  0  0  0
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 27 24  2  0  0  0  0
 28 26  2  0  0  0  0
 15  9  1  0  0  0  0
  5  4  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (642)
642

>  <Formula> (642)
C23H28N2O3

>  <MolWeight> (642)
380.48002

>  <PCAT_CMPD_ID> (642)
WAY-345727

>  <CNC_ID> (642)
359433659

>  <transfer_container_id> (642)
PTN000000075

>  <COMPOUND_NUMBER> (642)
WAY-345727

>  <BAR_CODE_NO> (642)
2556110

>  <LOCATION_CODE> (642)
PTNCS

>  <AMOUNT_CURRENT> (642)
32.9

$$$$
WAY-345922
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    7.8542   -5.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1417   -4.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  9  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  2  0  0  0  0
 13  8  2  0  0  0  0
 14 10  1  0  0  0  0
 15  6  1  0  0  0  0
 16 10  2  0  0  0  0
 17 11  2  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20 21  2  0  0  0  0
 21 19  1  0  0  0  0
 22 18  2  0  0  0  0
 23 20  1  0  0  0  0
 24 11  1  0  0  0  0
 25 17  1  0  0  0  0
 26 17  1  0  0  0  0
 27 24  2  0  0  0  0
 28 27  1  0  0  0  0
  6  4  2  0  0  0  0
  7  5  1  0  0  0  0
 28 26  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (643)
643

>  <Formula> (643)
C20H14ClN3O3S

>  <MolWeight> (643)
411.86146

>  <PCAT_CMPD_ID> (643)
WAY-345922

>  <CNC_ID> (643)
359433827

>  <transfer_container_id> (643)
PTN000000075

>  <COMPOUND_NUMBER> (643)
WAY-345922

>  <BAR_CODE_NO> (643)
2557568

>  <LOCATION_CODE> (643)
PTNCS

>  <AMOUNT_CURRENT> (643)
28.5

$$$$
WAY-345956
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    5.3542   -5.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4 10  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  4  2  0  0  0  0
  8  4  1  0  0  0  0
  9  6  1  0  0  0  0
 10  1  1  0  0  0  0
 11  7  1  0  0  0  0
 12  8  2  0  0  0  0
 13 12  1  0  0  0  0
 14  5  1  0  0  0  0
 15  2  1  0  0  0  0
 16  3  2  0  0  0  0
 17  9  1  0  0  0  0
 18 11  1  0  0  0  0
 19 14  2  0  0  0  0
 20 12  1  0  0  0  0
 21 17  2  0  0  0  0
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 23 15  1  0  0  0  0
 24 15  2  0  0  0  0
 25 24  1  0  0  0  0
 26 23  2  0  0  0  0
 27 25  2  0  0  0  0
  5  9  2  0  0  0  0
 13 11  2  0  0  0  0
 21 19  1  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (644)
644

>  <Formula> (644)
C19H13ClN4O2S

>  <MolWeight> (644)
396.85012

>  <PCAT_CMPD_ID> (644)
WAY-345956

>  <CNC_ID> (644)
359433859

>  <transfer_container_id> (644)
PTN000000075

>  <COMPOUND_NUMBER> (644)
WAY-345956

>  <BAR_CODE_NO> (644)
2556137

>  <LOCATION_CODE> (644)
PTNCS

>  <AMOUNT_CURRENT> (644)
32.8

$$$$
WAY-346562
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   13.8750   -7.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8  9  1  0  0  0  0
  9 15  1  0  0  0  0
 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  2  0  0  0  0
 14  8  2  0  0  0  0
 15 21  2  0  0  0  0
 16  2  1  0  0  0  0
 17 12  1  0  0  0  0
 18  4  1  0  0  0  0
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 20 22  2  0  0  0  0
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 24  6  2  0  0  0  0
 25  8  1  0  0  0  0
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 27 24  1  0  0  0  0
 28 27  2  0  0  0  0
  3  5  1  0  0  0  0
 26 28  1  0  0  0  0
 20 15  1  0  0  0  0
M  END
>  <Mol_ID> (645)
645

>  <Formula> (645)
C22H21FN2O2S

>  <MolWeight> (645)
396.4777432

>  <PCAT_CMPD_ID> (645)
WAY-346562

>  <CNC_ID> (645)
359434447

>  <transfer_container_id> (645)
PTN000000075

>  <COMPOUND_NUMBER> (645)
WAY-346562

>  <BAR_CODE_NO> (645)
2556814

>  <LOCATION_CODE> (645)
PTNCS

>  <AMOUNT_CURRENT> (645)
32.5

$$$$
WAY-346620
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
   10.2792   -6.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  2  0  0  0  0
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 10  5  1  0  0  0  0
 11 18  2  0  0  0  0
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 14  1  1  0  0  0  0
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 18 16  1  0  0  0  0
  3  4  1  0  0  0  0
 17 11  1  0  0  0  0
M  END
>  <Mol_ID> (646)
646

>  <Formula> (646)
C12H14ClN3O2

>  <MolWeight> (646)
267.71146

>  <PCAT_CMPD_ID> (646)
WAY-346620

>  <CNC_ID> (646)
359434503

>  <transfer_container_id> (646)
PTN000000075

>  <COMPOUND_NUMBER> (646)
WAY-346620

>  <BAR_CODE_NO> (646)
2556884

>  <LOCATION_CODE> (646)
PTNCS

>  <AMOUNT_CURRENT> (646)
32.1

$$$$
WAY-346713
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    9.4292   -5.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  8  1  0  0  0  0
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 13  2  1  0  0  0  0
 14  7  2  0  0  0  0
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 16  8  2  0  0  0  0
 17 10  2  0  0  0  0
 18 16  1  0  0  0  0
 19  9  1  0  0  0  0
 20  7  1  0  0  0  0
 21 12  1  0  0  0  0
 22 13  1  0  0  0  0
 23 13  2  0  0  0  0
 24 15  1  0  0  0  0
 25 20  1  0  0  0  0
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 27 22  2  0  0  0  0
 28 23  1  0  0  0  0
 29 28  2  0  0  0  0
  4  5  2  0  0  0  0
 29 27  1  0  0  0  0
 15 12  1  0  0  0  0
M  END
>  <Mol_ID> (647)
647

>  <Formula> (647)
C22H23N3O3S

>  <MolWeight> (647)
409.50132

>  <PCAT_CMPD_ID> (647)
WAY-346713

>  <CNC_ID> (647)
359434597

>  <transfer_container_id> (647)
PTN000000075

>  <COMPOUND_NUMBER> (647)
WAY-346713

>  <BAR_CODE_NO> (647)
2556916

>  <LOCATION_CODE> (647)
PTNCS

>  <AMOUNT_CURRENT> (647)
27

$$$$
WAY-347091
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14 15  1  0  0  0  0
 15 13  2  0  0  0  0
 16  6  1  0  0  0  0
 17  6  2  0  0  0  0
 18 19  2  0  0  0  0
 19 17  1  0  0  0  0
 20 16  2  0  0  0  0
 21 18  1  0  0  0  0
 22  7  1  0  0  0  0
 23 14  1  0  0  0  0
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 25 23  2  0  0  0  0
  3 11  1  0  0  0  0
 14  7  2  0  0  0  0
 25 24  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (648)
648

>  <Formula> (648)
C21H20N2O2

>  <MolWeight> (648)
332.3957

>  <PCAT_CMPD_ID> (648)
WAY-347091

>  <CNC_ID> (648)
359434962

>  <transfer_container_id> (648)
PTN000000075

>  <COMPOUND_NUMBER> (648)
WAY-347091

>  <BAR_CODE_NO> (648)
2557360

>  <LOCATION_CODE> (648)
PTNCS

>  <AMOUNT_CURRENT> (648)
32.8

$$$$
WAY-347098
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
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 10 18  1  0  0  0  0
 11  5  1  0  0  0  0
 12  1  1  0  0  0  0
 13 12  1  0  0  0  0
 14  6  1  0  0  0  0
 15  2  2  0  0  0  0
 16 13  2  0  0  0  0
 17 13  1  0  0  0  0
 18 14  1  0  0  0  0
 19  8  2  0  0  0  0
 20 11  2  0  0  0  0
 21 23  1  0  0  0  0
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 27 20  1  0  0  0  0
  9  6  2  0  0  0  0
 22 21  2  0  0  0  0
  2  8  1  0  0  0  0
 26 19  1  0  0  0  0
M  END
>  <Mol_ID> (649)
649

>  <Formula> (649)
C19H17N5OS2

>  <MolWeight> (649)
395.50118

>  <PCAT_CMPD_ID> (649)
WAY-347098

>  <CNC_ID> (649)
359434969

>  <transfer_container_id> (649)
PTN000000075

>  <COMPOUND_NUMBER> (649)
WAY-347098

>  <BAR_CODE_NO> (649)
2557334

>  <LOCATION_CODE> (649)
PTNCS

>  <AMOUNT_CURRENT> (649)
32.2

$$$$
WAY-347188
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  3  2  2  0  0  0  0
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 10  9  1  0  0  0  0
 11  6  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
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 16  1  1  0  0  0  0
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 19  8  2  0  0  0  0
 20 11  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  1  0  0  0  0
 23  9  1  0  0  0  0
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 25 24  1  0  0  0  0
 15  7  1  0  0  0  0
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 21 20  2  0  0  0  0
M  END
>  <Mol_ID> (650)
650

>  <Formula> (650)
C16H21N3O4S2

>  <MolWeight> (650)
383.48564

>  <PCAT_CMPD_ID> (650)
WAY-347188

>  <CNC_ID> (650)
359435057

>  <transfer_container_id> (650)
PTN000000075

>  <COMPOUND_NUMBER> (650)
WAY-347188

>  <BAR_CODE_NO> (650)
2557426

>  <LOCATION_CODE> (650)
PTNCS

>  <AMOUNT_CURRENT> (650)
32.8

$$$$
WAY-347423
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
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M  END
>  <Mol_ID> (651)
651

>  <Formula> (651)
C14H15NO2S

>  <MolWeight> (651)
261.3394

>  <PCAT_CMPD_ID> (651)
WAY-347423

>  <CNC_ID> (651)
359435286

>  <transfer_container_id> (651)
PTN000000075

>  <COMPOUND_NUMBER> (651)
WAY-347423

>  <BAR_CODE_NO> (651)
2557588

>  <LOCATION_CODE> (651)
PTNCS

>  <AMOUNT_CURRENT> (651)
32.4

$$$$
WAY-347660
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   14.0250  -11.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
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  7  1  2  0  0  0  0
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  9  6  1  0  0  0  0
 10  2  1  0  0  0  0
 11  2  1  0  0  0  0
 12  3  2  0  0  0  0
 13  5  2  0  0  0  0
 14 16  2  0  0  0  0
 15  4  1  0  0  0  0
 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18 11  1  0  0  0  0
 19 10  1  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 14  8  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (652)
652

>  <Formula> (652)
C15H18Cl2N2O2

>  <MolWeight> (652)
329.22162

>  <PCAT_CMPD_ID> (652)
WAY-347660

>  <CNC_ID> (652)
359435513

>  <transfer_container_id> (652)
PTN000000075

>  <COMPOUND_NUMBER> (652)
WAY-347660

>  <BAR_CODE_NO> (652)
2557823

>  <LOCATION_CODE> (652)
PTNCS

>  <AMOUNT_CURRENT> (652)
32.7

$$$$
WAY-347782
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    3.1150    8.3957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  5  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6 11  1  0  0  0  0
  7  1  1  0  0  0  0
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 10  6  2  0  0  0  0
 11  7  1  0  0  0  0
 12  3  1  0  0  0  0
 13  4  2  0  0  0  0
 14  5  2  0  0  0  0
 15  9  2  0  0  0  0
 16  9  1  0  0  0  0
 17 12  2  0  0  0  0
 18 12  1  0  0  0  0
 19 13  1  0  0  0  0
 20 19  2  0  0  0  0
 21 16  2  0  0  0  0
 22 15  1  0  0  0  0
 23 18  2  0  0  0  0
 24 17  1  0  0  0  0
 25 23  1  0  0  0  0
 26 21  1  0  0  0  0
 22 26  2  0  0  0  0
 20 14  1  0  0  0  0
 25 24  2  0  0  0  0
M  END
>  <Mol_ID> (653)
653

>  <Formula> (653)
C21H17NO3S

>  <MolWeight> (653)
363.42958

>  <PCAT_CMPD_ID> (653)
WAY-347782

>  <CNC_ID> (653)
359435631

>  <transfer_container_id> (653)
PTN000000075

>  <COMPOUND_NUMBER> (653)
WAY-347782

>  <BAR_CODE_NO> (653)
2558025

>  <LOCATION_CODE> (653)
PTNCS

>  <AMOUNT_CURRENT> (653)
32.6

$$$$
WAY-347791
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  4  6  1  0  0  0  0
  5  1  1  0  0  0  0
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 10  7  2  0  0  0  0
 11 14  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  1  0  0  0  0
 14 15  1  0  0  0  0
 15  9  1  0  0  0  0
 16  5  1  0  0  0  0
 17  6  1  0  0  0  0
 18 12  1  0  0  0  0
 19 11  2  0  0  0  0
 20 12  2  0  0  0  0
 21 16  2  0  0  0  0
 22 21  1  0  0  0  0
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
  4  3  1  0  0  0  0
 22 17  2  0  0  0  0
 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (654)
654

>  <Formula> (654)
C18H16N2O4

>  <MolWeight> (654)
324.33064

>  <PCAT_CMPD_ID> (654)
WAY-347791

>  <CNC_ID> (654)
359435639

>  <transfer_container_id> (654)
PTN000000075

>  <COMPOUND_NUMBER> (654)
WAY-347791

>  <BAR_CODE_NO> (654)
2558035

>  <LOCATION_CODE> (654)
PTNCS

>  <AMOUNT_CURRENT> (654)
32.9

$$$$
WAY-347792
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
 13 12  1  0  0  0  0
 14  7  2  0  0  0  0
 15 10  2  0  0  0  0
 16 11  1  0  0  0  0
 17 11  2  0  0  0  0
 18 19  2  0  0  0  0
 19  9  1  0  0  0  0
 20 21  2  0  0  0  0
 21 17  1  0  0  0  0
 22 16  2  0  0  0  0
 23 20  1  0  0  0  0
 24 18  1  0  0  0  0
 25 24  1  0  0  0  0
  2  4  1  0  0  0  0
 18  6  1  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (655)
655

>  <Formula> (655)
C19H15FO5

>  <MolWeight> (655)
342.3178032

>  <PCAT_CMPD_ID> (655)
WAY-347792

>  <CNC_ID> (655)
359435640

>  <transfer_container_id> (655)
PTN000000075

>  <COMPOUND_NUMBER> (655)
WAY-347792

>  <BAR_CODE_NO> (655)
2558036

>  <LOCATION_CODE> (655)
PTNCS

>  <AMOUNT_CURRENT> (655)
24.6

$$$$
WAY-347799
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 16 11  2  0  0  0  0
 17 24  2  0  0  0  0
 18 12  2  0  0  0  0
 19  7  1  0  0  0  0
 20  6  1  0  0  0  0
 21 10  1  0  0  0  0
 22 11  1  0  0  0  0
 23 25  2  0  0  0  0
 24 26  1  0  0  0  0
 25 14  1  0  0  0  0
 26 14  2  0  0  0  0
 27 16  1  0  0  0  0
 28 16  1  0  0  0  0
 29 22  2  0  0  0  0
 30 29  1  0  0  0  0
  8  4  1  0  0  0  0
 28 30  2  0  0  0  0
 17 23  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
>  <Mol_ID> (656)
656

>  <Formula> (656)
C23H23N5OS

>  <MolWeight> (656)
417.52662

>  <PCAT_CMPD_ID> (656)
WAY-347799

>  <CNC_ID> (656)
359435647

>  <transfer_container_id> (656)
PTN000000075

>  <COMPOUND_NUMBER> (656)
WAY-347799

>  <BAR_CODE_NO> (656)
2558004

>  <LOCATION_CODE> (656)
PTNCS

>  <AMOUNT_CURRENT> (656)
32.8

$$$$
WAY-347808
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  2  0  0  0  0
  9 15  1  0  0  0  0
 10 12  3  0  0  0  0
 11  6  1  0  0  0  0
 12 18  1  0  0  0  0
 13  8  1  0  0  0  0
 14  9  1  0  0  0  0
 15 11  1  0  0  0  0
 16  5  1  0  0  0  0
 17  9  2  0  0  0  0
 18 19  1  0  0  0  0
 19 14  1  0  0  0  0
 20 14  1  0  0  0  0
 21 16  1  0  0  0  0
 22 16  2  0  0  0  0
 23 22  1  0  0  0  0
 24 21  2  0  0  0  0
 25 23  2  0  0  0  0
  4  5  1  0  0  0  0
  7 13  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (657)
657

>  <Formula> (657)
C18H16N4OS2

>  <MolWeight> (657)
368.47584

>  <PCAT_CMPD_ID> (657)
WAY-347808

>  <CNC_ID> (657)
359435656

>  <transfer_container_id> (657)
PTN000000075

>  <COMPOUND_NUMBER> (657)
WAY-347808

>  <BAR_CODE_NO> (657)
2558013

>  <LOCATION_CODE> (657)
PTNCS

>  <AMOUNT_CURRENT> (657)
32.2

$$$$
WAY-348857
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    7.9042   -5.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6917   -8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  2  0  0  0  0
  8  4  2  0  0  0  0
  9 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12  9  1  0  0  0  0
 13  4  1  0  0  0  0
 14  8  1  0  0  0  0
 15 11  2  0  0  0  0
 16 13  1  0  0  0  0
 17 10  1  0  0  0  0
 18 21  1  0  0  0  0
 19 12  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22  7  1  0  0  0  0
 23 22  1  0  0  0  0
  7  3  1  0  0  0  0
  6 14  2  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (658)
658

>  <Formula> (658)
C15H13ClN4OS2

>  <MolWeight> (658)
364.87292

>  <PCAT_CMPD_ID> (658)
WAY-348857

>  <CNC_ID> (658)
359436665

>  <transfer_container_id> (658)
PTN000000075

>  <COMPOUND_NUMBER> (658)
WAY-348857

>  <BAR_CODE_NO> (658)
2559057

>  <LOCATION_CODE> (658)
PTNCS

>  <AMOUNT_CURRENT> (658)
32.5

$$$$
WAY-348864
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    6.9673    4.3554    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
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  7 14  1  0  0  0  0
  8  2  2  0  0  0  0
  9  3  2  0  0  0  0
 10  6  2  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  1  1  0  0  0  0
 14 19  1  0  0  0  0
 15 11  1  0  0  0  0
 16 10  1  0  0  0  0
 17  4  1  0  0  0  0
 18  5  1  0  0  0  0
 19 13  1  0  0  0  0
 20 21  1  0  0  0  0
 21 11  2  0  0  0  0
 22 10  1  0  0  0  0
 23 17  2  0  0  0  0
 24 18  2  0  0  0  0
  5  4  2  0  0  0  0
 24 23  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (659)
659

>  <Formula> (659)
C17H11F2NO4

>  <MolWeight> (659)
331.2703464

>  <PCAT_CMPD_ID> (659)
WAY-348864

>  <CNC_ID> (659)
359436672

>  <transfer_container_id> (659)
PTN000000075

>  <COMPOUND_NUMBER> (659)
WAY-348864

>  <BAR_CODE_NO> (659)
2559064

>  <LOCATION_CODE> (659)
PTNCS

>  <AMOUNT_CURRENT> (659)
32.9

$$$$
WAY-349426
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   10.0542  -10.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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  8  9  1  0  0  0  0
  9 12  2  0  0  0  0
 10 14  1  0  0  0  0
 11  5  2  0  0  0  0
 12 13  1  0  0  0  0
 13  5  1  0  0  0  0
 14 15  2  0  0  0  0
 15 12  1  0  0  0  0
 16  6  2  0  0  0  0
 17  7  2  0  0  0  0
 18  8  1  0  0  0  0
 19 10  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  1  0  0  0  0
  7  6  1  0  0  0  0
 20 21  2  0  0  0  0
  8 10  2  0  0  0  0
M  END
>  <Mol_ID> (660)
660

>  <Formula> (660)
C17H17N3O

>  <MolWeight> (660)
279.33638

>  <PCAT_CMPD_ID> (660)
WAY-349426

>  <CNC_ID> (660)
359437210

>  <transfer_container_id> (660)
PTN000000075

>  <COMPOUND_NUMBER> (660)
WAY-349426

>  <BAR_CODE_NO> (660)
2560178

>  <LOCATION_CODE> (660)
PTNCS

>  <AMOUNT_CURRENT> (660)
32.4

$$$$
WAY-349634
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  4  1  1  0  0  0  0
  5 16  2  0  0  0  0
  6 17  1  0  0  0  0
  7  2  1  0  0  0  0
  8 11  1  0  0  0  0
  9  5  1  0  0  0  0
 10  6  1  0  0  0  0
 11  1  1  0  0  0  0
 12 15  1  0  0  0  0
 13  6  2  0  0  0  0
 14  4  1  0  0  0  0
 15  8  1  0  0  0  0
 16 12  1  0  0  0  0
 17 12  2  0  0  0  0
 18  2  2  0  0  0  0
 19  9  2  0  0  0  0
 20 10  2  0  0  0  0
 21  8  2  0  0  0  0
 22  9  1  0  0  0  0
 23 10  1  0  0  0  0
 24  4  2  0  0  0  0
 25 14  2  0  0  0  0
 26 22  1  0  0  0  0
 27 23  1  0  0  0  0
 28 24  1  0  0  0  0
 29 28  2  0  0  0  0
  3  7  2  0  0  0  0
 29 25  1  0  0  0  0
 13  5  1  0  0  0  0
M  END
>  <Mol_ID> (661)
661

>  <Formula> (661)
C20H17N3O6

>  <MolWeight> (661)
395.36548

>  <PCAT_CMPD_ID> (661)
WAY-349634

>  <CNC_ID> (661)
359437414

>  <transfer_container_id> (661)
PTN000000075

>  <COMPOUND_NUMBER> (661)
WAY-349634

>  <BAR_CODE_NO> (661)
2559890

>  <LOCATION_CODE> (661)
PTNCS

>  <AMOUNT_CURRENT> (661)
32.9

$$$$
WAY-349809
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   13.1542   -9.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1750   -7.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0917   -9.5667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0417   -7.9625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0375   -9.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1167   -7.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1292   -9.3375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1542   -7.5875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1292   -6.3167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.9750   -7.5667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0750  -10.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3875   -4.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4375   -2.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 13  1  0  0  0  0
 10  9  2  0  0  0  0
 11  7  2  0  0  0  0
 12 10  1  0  0  0  0
 13 15  1  0  0  0  0
 14  9  1  0  0  0  0
 15 18  1  0  0  0  0
 16 14  1  0  0  0  0
 17 12  1  0  0  0  0
 18  8  1  0  0  0  0
 19  5  2  0  0  0  0
 20  6  2  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 23 28  1  0  0  0  0
 24 15  2  0  0  0  0
 25 17  1  0  0  0  0
 26  3  1  0  0  0  0
 27  4  1  0  0  0  0
 28 25  2  0  0  0  0
 29 22  1  0  0  0  0
 30 23  1  0  0  0  0
  8 11  1  0  0  0  0
  4  6  1  0  0  0  0
 16 12  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (662)
662

>  <Formula> (662)
C20H20N6O3S

>  <MolWeight> (662)
424.4762

>  <PCAT_CMPD_ID> (662)
WAY-349809

>  <CNC_ID> (662)
359437576

>  <transfer_container_id> (662)
PTN000000075

>  <COMPOUND_NUMBER> (662)
WAY-349809

>  <BAR_CODE_NO> (662)
2560089

>  <LOCATION_CODE> (662)
PTNCS

>  <AMOUNT_CURRENT> (662)
32

$$$$
WAY-349828
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   10.8292  -11.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8667  -11.9042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.2042  -10.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1000  -11.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -13.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9917  -12.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7250  -12.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6292  -11.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9292  -10.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2000  -12.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2750   -9.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7292  -10.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9917  -10.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0042   -9.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3542   -8.3542    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.0250  -11.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3167  -11.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3792  -10.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  6  1  0  0  0  0
  8  4  2  0  0  0  0
  9 14  1  0  0  0  0
 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
 12 10  1  0  0  0  0
 13  4  1  0  0  0  0
 14 13  2  0  0  0  0
 15 12  2  0  0  0  0
 16 15  1  0  0  0  0
 17 18  1  0  0  0  0
 18 10  2  0  0  0  0
 19 17  2  0  0  0  0
  6  9  2  0  0  0  0
  5  2  2  0  0  0  0
 19 15  1  0  0  0  0
M  END
>  <Mol_ID> (663)
663

>  <Formula> (663)
C14H9FN2OS

>  <MolWeight> (663)
272.2974632

>  <PCAT_CMPD_ID> (663)
WAY-349828

>  <CNC_ID> (663)
359437595

>  <transfer_container_id> (663)
PTN000000075

>  <COMPOUND_NUMBER> (663)
WAY-349828

>  <BAR_CODE_NO> (663)
2560053

>  <LOCATION_CODE> (663)
PTNCS

>  <AMOUNT_CURRENT> (663)
32.1

$$$$
WAY-349904
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   13.0750   -9.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2167   -8.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9042  -10.2042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0125   -8.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2750   -8.0625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3417   -5.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7042   -5.1417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5417   -8.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.9167   -3.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3292   -7.0792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 13  1  0  0  0  0
 10  9  2  0  0  0  0
 11  7  2  0  0  0  0
 12 10  1  0  0  0  0
 13 15  1  0  0  0  0
 14  9  1  0  0  0  0
 15 18  1  0  0  0  0
 16 14  1  0  0  0  0
 17 12  1  0  0  0  0
 18  8  1  0  0  0  0
 19  5  2  0  0  0  0
 20 22  1  0  0  0  0
 21  6  2  0  0  0  0
 22 17  2  0  0  0  0
 23 28  1  0  0  0  0
 24 15  2  0  0  0  0
 25 17  1  0  0  0  0
 26  3  1  0  0  0  0
 27  4  1  0  0  0  0
 28 25  2  0  0  0  0
 29 20  1  0  0  0  0
 30 23  1  0  0  0  0
 11  8  1  0  0  0  0
  6  4  1  0  0  0  0
 12 16  2  0  0  0  0
 23 20  2  0  0  0  0
M  END
>  <Mol_ID> (664)
664

>  <Formula> (664)
C18H14F2N6O3S

>  <MolWeight> (664)
432.4039664

>  <PCAT_CMPD_ID> (664)
WAY-349904

>  <CNC_ID> (664)
359437670

>  <transfer_container_id> (664)
PTN000000075

>  <COMPOUND_NUMBER> (664)
WAY-349904

>  <BAR_CODE_NO> (664)
2560116

>  <LOCATION_CODE> (664)
PTNCS

>  <AMOUNT_CURRENT> (664)
32.7

$$$$
WAY-349941
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   15.2917  -11.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -12.5000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.7875  -13.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9292   -6.3417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   15.8500  -10.0167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   12.6667  -13.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2417  -14.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.1542   -8.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7125   -6.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  8  1  0  0  0  0
  7  6  1  0  0  0  0
  8 14  1  0  0  0  0
  9  1  1  0  0  0  0
 10  8  2  0  0  0  0
 11  7  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
 14 19  1  0  0  0  0
 15  7  2  0  0  0  0
 16 11  1  0  0  0  0
 17  9  1  0  0  0  0
 18 11  2  0  0  0  0
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 20 16  1  0  0  0  0
 21 13  1  0  0  0  0
 22 12  1  0  0  0  0
 23 15  1  0  0  0  0
 24 23  2  0  0  0  0
  4  5  1  0  0  0  0
 22 21  2  0  0  0  0
 18 24  1  0  0  0  0
M  END
>  <Mol_ID> (665)
665

>  <Formula> (665)
C19H20N2OS2

>  <MolWeight> (665)
356.5049

>  <PCAT_CMPD_ID> (665)
WAY-349941

>  <CNC_ID> (665)
359437705

>  <transfer_container_id> (665)
PTN000000075

>  <COMPOUND_NUMBER> (665)
WAY-349941

>  <BAR_CODE_NO> (665)
2560207

>  <LOCATION_CODE> (665)
PTNCS

>  <AMOUNT_CURRENT> (665)
32.2

$$$$
WAY-349973
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    9.7042   -4.0667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4042   -5.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3042   -4.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7167   -6.4625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6375   -5.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3500   -6.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7917   -5.2417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8917   -6.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8  5  1  0  0  0  0
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 11  1  1  0  0  0  0
 12 14  1  0  0  0  0
 13 12  2  0  0  0  0
 14  7  1  0  0  0  0
 15 16  1  0  0  0  0
 16  8  2  0  0  0  0
 17 12  1  0  0  0  0
 18 15  1  0  0  0  0
 19 11  1  0  0  0  0
 20 11  1  0  0  0  0
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 23 19  1  0  0  0  0
 23 22  1  0  0  0  0
  4  6  1  0  0  0  0
 15  9  2  0  0  0  0
M  END
>  <Mol_ID> (666)
666

>  <Formula> (666)
C16H17ClN2O3S

>  <MolWeight> (666)
352.83578

>  <PCAT_CMPD_ID> (666)
WAY-349973

>  <CNC_ID> (666)
359437735

>  <transfer_container_id> (666)
PTN000000075

>  <COMPOUND_NUMBER> (666)
WAY-349973

>  <BAR_CODE_NO> (666)
2560193

>  <LOCATION_CODE> (666)
PTNCS

>  <AMOUNT_CURRENT> (666)
32.7

$$$$
WAY-350313
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.3667   -4.1292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2042   -5.0750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   13.6542   -9.1000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -7.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  2  1  0  0  0  0
  7  4  1  0  0  0  0
  8 15  2  0  0  0  0
  9 10  1  0  0  0  0
 10 13  1  0  0  0  0
 11  1  1  0  0  0  0
 12  9  1  0  0  0  0
 13 21  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16  6  1  0  0  0  0
 17  6  2  0  0  0  0
 18  7  1  0  0  0  0
 19  9  2  0  0  0  0
 20 10  2  0  0  0  0
 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  2  0  0  0  0
  3  5  1  0  0  0  0
  8 14  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
>  <Mol_ID> (667)
667

>  <Formula> (667)
C16H15ClN4OS

>  <MolWeight> (667)
346.8345

>  <PCAT_CMPD_ID> (667)
WAY-350313

>  <CNC_ID> (667)
359438057

>  <transfer_container_id> (667)
PTN000000075

>  <COMPOUND_NUMBER> (667)
WAY-350313

>  <BAR_CODE_NO> (667)
2560560

>  <LOCATION_CODE> (667)
PTNCS

>  <AMOUNT_CURRENT> (667)
30

$$$$
WAY-350722
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   10.2625   -6.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2792   -2.5917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  2  1  0  0  0  0
  4  8  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8 17  1  0  0  0  0
  9  1  2  0  0  0  0
 10  4  2  0  0  0  0
 11  1  1  0  0  0  0
 12  3  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  2  0  0  0  0
 15 19  1  0  0  0  0
 16  5  1  0  0  0  0
 17 11  1  0  0  0  0
 18 20  2  0  0  0  0
 19 12  2  0  0  0  0
 20 14  1  0  0  0  0
 21 13  2  0  0  0  0
 22 15  1  0  0  0  0
 23 18  1  0  0  0  0
 18 21  1  0  0  0  0
 15  6  2  0  0  0  0
M  END
>  <Mol_ID> (668)
668

>  <Formula> (668)
C16H13ClF2N2O2

>  <MolWeight> (668)
338.7364264

>  <PCAT_CMPD_ID> (668)
WAY-350722

>  <CNC_ID> (668)
359438453

>  <transfer_container_id> (668)
PTN000000075

>  <COMPOUND_NUMBER> (668)
WAY-350722

>  <BAR_CODE_NO> (668)
2561032

>  <LOCATION_CODE> (668)
PTNCS

>  <AMOUNT_CURRENT> (668)
32.5

$$$$
WAY-350824
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   10.1750   -5.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6125   -5.6417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
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 17  8  1  0  0  0  0
 18 17  1  0  0  0  0
  7  5  2  0  0  0  0
 13 14  1  0  0  0  0
 18 15  1  0  0  0  0
M  END
>  <Mol_ID> (669)
669

>  <Formula> (669)
C13H14N2O2S

>  <MolWeight> (669)
262.32746

>  <PCAT_CMPD_ID> (669)
WAY-350824

>  <CNC_ID> (669)
359438551

>  <transfer_container_id> (669)
PTN000000075

>  <COMPOUND_NUMBER> (669)
WAY-350824

>  <BAR_CODE_NO> (669)
2561193

>  <LOCATION_CODE> (669)
PTNCS

>  <AMOUNT_CURRENT> (669)
33

$$$$
WAY-351060
csChFnd80/10111816222D

 15 17  0  0  0  0  0  0  0  0999 V2000
    0.6862   -1.0584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6069   -0.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5724    4.2071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
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  6 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 13 15  1  0  0  0  0
  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
 14 15  1  0  0  0  0
M  END
>  <Mol_ID> (670)
670

>  <Formula> (670)
C10H11N3OS

>  <MolWeight> (670)
221.27884

>  <PCAT_CMPD_ID> (670)
WAY-351060

>  <CNC_ID> (670)
359438774

>  <transfer_container_id> (670)
PTN000000075

>  <COMPOUND_NUMBER> (670)
WAY-351060

>  <BAR_CODE_NO> (670)
2561285

>  <LOCATION_CODE> (670)
PTNCS

>  <AMOUNT_CURRENT> (670)
29.5

$$$$
WAY-351063
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    9.6042   -7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7667   -5.9292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  2  0  0  0  0
 14  8  2  0  0  0  0
 15  6  2  0  0  0  0
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 24 21  1  0  0  0  0
  3  5  1  0  0  0  0
 14 13  1  0  0  0  0
 18 22  2  0  0  0  0
M  END
>  <Mol_ID> (671)
671

>  <Formula> (671)
C16H15N5O3

>  <MolWeight> (671)
325.322

>  <PCAT_CMPD_ID> (671)
WAY-351063

>  <CNC_ID> (671)
359438777

>  <transfer_container_id> (671)
PTN000000075

>  <COMPOUND_NUMBER> (671)
WAY-351063

>  <BAR_CODE_NO> (671)
2561288

>  <LOCATION_CODE> (671)
PTNCS

>  <AMOUNT_CURRENT> (671)
32.6

$$$$
WAY-351125
csChFnd80/10111816222D

 27 28  0  0  0  0  0  0  0  0999 V2000
   14.2417  -10.1750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5667  -11.6375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4042   -8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3167  -11.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6250   -8.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7250  -10.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7542   -7.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1417  -13.2042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9625   -9.9875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5792    2.0583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -10.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9667    3.6333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  4  2  0  0  0  0
  9  6  2  0  0  0  0
 10 16  1  0  0  0  0
 11 14  2  0  0  0  0
 12  3  1  0  0  0  0
 13 21  2  0  0  0  0
 14 22  1  0  0  0  0
 15  7  1  0  0  0  0
 16 15  1  0  0  0  0
 17  7  2  0  0  0  0
 18 10  2  0  0  0  0
 19  1  1  0  0  0  0
 20  2  1  0  0  0  0
 21 25  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 10  1  0  0  0  0
 25 22  2  0  0  0  0
 26 11  1  0  0  0  0
 27 13  1  0  0  0  0
  5  6  1  0  0  0  0
 11 13  1  0  0  0  0
M  END
>  <Mol_ID> (672)
672

>  <Formula> (672)
C18H21N3O6

>  <MolWeight> (672)
375.37584

>  <PCAT_CMPD_ID> (672)
WAY-351125

>  <CNC_ID> (672)
359438834

>  <transfer_container_id> (672)
PTN000000075

>  <COMPOUND_NUMBER> (672)
WAY-351125

>  <BAR_CODE_NO> (672)
2561378

>  <LOCATION_CODE> (672)
PTNCS

>  <AMOUNT_CURRENT> (672)
32.6

$$$$
WAY-351351
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
    1.4542   -0.7042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3917    0.6208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5458   -0.0625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1333    0.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1333   -0.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3000   -0.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3000    0.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8917   -1.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5875   -2.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  9  2  0  0  0  0
  8  5  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  2  0  0  0  0
 11  6  1  0  0  0  0
 12  6  2  0  0  0  0
 13  8  1  0  0  0  0
 14 13  1  0  0  0  0
  4  2  1  0  0  0  0
 10  7  1  0  0  0  0
M  END
>  <Mol_ID> (673)
673

>  <Formula> (673)
C9H9N3OS

>  <MolWeight> (673)
207.25226

>  <PCAT_CMPD_ID> (673)
WAY-351351

>  <CNC_ID> (673)
359439049

>  <transfer_container_id> (673)
PTN000000075

>  <COMPOUND_NUMBER> (673)
WAY-351351

>  <BAR_CODE_NO> (673)
2561700

>  <LOCATION_CODE> (673)
PTNCS

>  <AMOUNT_CURRENT> (673)
32.9

$$$$
WAY-351539
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    9.7917   -5.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9792   -4.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1667   -5.4292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8542   -6.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9792   -6.5292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.2292   -6.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6667   -4.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6667   -6.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9250   -7.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3000   -7.8417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1625   -7.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.8417   -9.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3125   -5.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  9  2  0  0  0  0
 11  4  2  0  0  0  0
 12  7  1  0  0  0  0
 13  9  1  0  0  0  0
 14  6  2  0  0  0  0
 15  8  1  0  0  0  0
 16 15  2  0  0  0  0
 17 21  2  0  0  0  0
 18 12  2  0  0  0  0
 19 12  1  0  0  0  0
 20 13  1  0  0  0  0
 21 14  1  0  0  0  0
  8  7  2  0  0  0  0
 16 18  1  0  0  0  0
 10 17  1  0  0  0  0
M  END
>  <Mol_ID> (674)
674

>  <Formula> (674)
C15H13N3OS2

>  <MolWeight> (674)
315.41322

>  <PCAT_CMPD_ID> (674)
WAY-351539

>  <CNC_ID> (674)
359439232

>  <transfer_container_id> (674)
PTN000000075

>  <COMPOUND_NUMBER> (674)
WAY-351539

>  <BAR_CODE_NO> (674)
2561773

>  <LOCATION_CODE> (674)
PTNCS

>  <AMOUNT_CURRENT> (674)
32.3

$$$$
WAY-351576
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    9.8167   -8.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1292   -6.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0292   -6.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3792   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1750   -5.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4042   -4.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0667   -2.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7875   -5.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3875   -6.8292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7167   -5.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.6667   -6.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
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  6  7  1  0  0  0  0
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  8  6  2  0  0  0  0
  9  3  2  0  0  0  0
 10  5  2  0  0  0  0
 11 12  1  0  0  0  0
 12  3  1  0  0  0  0
 13  2  1  0  0  0  0
 14 18  1  0  0  0  0
 15  4  1  0  0  0  0
 16  8  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  2  0  0  0  0
 19  6  1  0  0  0  0
 20  8  1  0  0  0  0
 21 19  2  0  0  0  0
 22 21  1  0  0  0  0
 13 14  2  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (675)
675

>  <Formula> (675)
C15H12ClFN2O3

>  <MolWeight> (675)
322.7187832

>  <PCAT_CMPD_ID> (675)
WAY-351576

>  <CNC_ID> (675)
359439269

>  <transfer_container_id> (675)
PTN000000075

>  <COMPOUND_NUMBER> (675)
WAY-351576

>  <BAR_CODE_NO> (675)
2561812

>  <LOCATION_CODE> (675)
PTNCS

>  <AMOUNT_CURRENT> (675)
32.2

$$$$
WAY-351675
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
    7.2042   -2.0250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4917   -3.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8292   -6.7375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3667   -7.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
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  6  2  1  0  0  0  0
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  8  1  1  0  0  0  0
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 10  6  2  0  0  0  0
 11  9  2  0  0  0  0
 12 10  1  0  0  0  0
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 15  3  1  0  0  0  0
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 18  9  1  0  0  0  0
 19 12  1  0  0  0  0
 20  8  2  0  0  0  0
 21  8  1  0  0  0  0
 22 26  1  0  0  0  0
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 24 11  1  0  0  0  0
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 26 18  2  0  0  0  0
 27 21  2  0  0  0  0
 28 20  1  0  0  0  0
 29 22  1  0  0  0  0
 30 25  1  0  0  0  0
 31  5  1  0  0  0  0
  2  5  1  0  0  0  0
 25 28  2  0  0  0  0
 22 14  2  0  0  0  0
M  END
>  <Mol_ID> (676)
676

>  <Formula> (676)
C21H15ClF3N3O3

>  <MolWeight> (676)
449.8103096

>  <PCAT_CMPD_ID> (676)
WAY-351675

>  <CNC_ID> (676)
359439364

>  <transfer_container_id> (676)
PTN000000075

>  <COMPOUND_NUMBER> (676)
WAY-351675

>  <BAR_CODE_NO> (676)
2561927

>  <LOCATION_CODE> (676)
PTNCS

>  <AMOUNT_CURRENT> (676)
32.5

$$$$
WAY-351715
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    7.2375   -5.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7250   -4.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2542   -5.2042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7750   -4.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2292   -3.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2542   -3.4167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7167   -4.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5500   -5.9625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.6167   -5.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8042   -4.3125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.3375   -5.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8542   -6.0875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3167   -5.2042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9625   -3.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8542   -4.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9542   -7.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9667   -9.6292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11 14  1  0  0  0  0
 12 11  1  0  0  0  0
 13  5  2  0  0  0  0
 14 10  1  0  0  0  0
 15  7  1  0  0  0  0
 16 11  2  0  0  0  0
 17 12  1  0  0  0  0
 18 17  1  0  0  0  0
 19 23  1  0  0  0  0
 20 18  2  0  0  0  0
 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  2  0  0  0  0
 24 19  1  0  0  0  0
 25 14  1  0  0  0  0
 26 15  1  0  0  0  0
 27 15  2  0  0  0  0
 28 24  1  0  0  0  0
 29 26  2  0  0  0  0
 30 27  1  0  0  0  0
 31 30  2  0  0  0  0
  7  9  2  0  0  0  0
  6  5  1  0  0  0  0
 31 29  1  0  0  0  0
 22 19  2  0  0  0  0
M  END
>  <Mol_ID> (677)
677

>  <Formula> (677)
C23H21N3O3S2

>  <MolWeight> (677)
451.56114

>  <PCAT_CMPD_ID> (677)
WAY-351715

>  <CNC_ID> (677)
359439403

>  <transfer_container_id> (677)
PTN000000075

>  <COMPOUND_NUMBER> (677)
WAY-351715

>  <BAR_CODE_NO> (677)
2561939

>  <LOCATION_CODE> (677)
PTNCS

>  <AMOUNT_CURRENT> (677)
32.5

$$$$
WAY-351998
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    8.1125   -6.1292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5250   -6.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5375   -3.3667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8917   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4792   -7.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7625   -4.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2375   -8.9375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.8500   -8.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8917   -7.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6000  -10.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1292   -3.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7667  -11.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.9375  -13.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2042   -3.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2417   -7.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.4417   -2.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 11  1  0  0  0  0
  4  1  1  0  0  0  0
  5  9  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  1  1  0  0  0  0
 10  8  2  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13  2  2  0  0  0  0
 14  5  2  0  0  0  0
 15  4  2  0  0  0  0
 16  8  1  0  0  0  0
 17 10  1  0  0  0  0
 18 12  1  0  0  0  0
 19 12  1  0  0  0  0
 20 12  1  0  0  0  0
 21 11  2  0  0  0  0
 22 15  1  0  0  0  0
 23 16  2  0  0  0  0
 24 23  1  0  0  0  0
 25 22  2  0  0  0  0
  3  6  2  0  0  0  0
 21 25  1  0  0  0  0
 24 17  2  0  0  0  0
M  END
>  <Mol_ID> (678)
678

>  <Formula> (678)
C20H21N3O2

>  <MolWeight> (678)
335.39964

>  <PCAT_CMPD_ID> (678)
WAY-351998

>  <CNC_ID> (678)
359439683

>  <transfer_container_id> (678)
PTN000000075

>  <COMPOUND_NUMBER> (678)
WAY-351998

>  <BAR_CODE_NO> (678)
2562283

>  <LOCATION_CODE> (678)
PTNCS

>  <AMOUNT_CURRENT> (678)
32.8

$$$$
WAY-352049
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.6125   -8.8167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292   -7.8375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5375  -11.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6500  -11.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1875   -9.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9792  -10.7542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.3167  -10.7292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.8875  -11.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3542   -8.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2042   -6.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2292   -8.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6542   -7.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  7  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7 14  1  0  0  0  0
  8 13  2  0  0  0  0
  9  1  2  0  0  0  0
 10  1  2  0  0  0  0
 11  5  2  0  0  0  0
 12 18  2  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
 15  3  2  0  0  0  0
 16  6  1  0  0  0  0
 17  4  2  0  0  0  0
 18 17  1  0  0  0  0
 19 12  1  0  0  0  0
 20 16  1  0  0  0  0
 21  5  1  0  0  0  0
 22  6  2  0  0  0  0
 23 21  2  0  0  0  0
 24 23  1  0  0  0  0
 25 16  2  0  0  0  0
 26 22  1  0  0  0  0
 27 26  2  0  0  0  0
 24 14  2  0  0  0  0
 27 25  1  0  0  0  0
 12  8  1  0  0  0  0
M  END
>  <Mol_ID> (679)
679

>  <Formula> (679)
C18H13Cl2N3O3S

>  <MolWeight> (679)
422.28512

>  <PCAT_CMPD_ID> (679)
WAY-352049

>  <CNC_ID> (679)
359439733

>  <transfer_container_id> (679)
PTN000000075

>  <COMPOUND_NUMBER> (679)
WAY-352049

>  <BAR_CODE_NO> (679)
2562328

>  <LOCATION_CODE> (679)
PTNCS

>  <AMOUNT_CURRENT> (679)
32.4

$$$$
WAY-352100
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    8.2792   -4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292   -4.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6542   -3.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2625   -5.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0167   -6.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2625   -6.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7500   -5.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.1042    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   11.9917   -4.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  3  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  2  0  0  0  0
 12  2  2  0  0  0  0
 13  8  2  0  0  0  0
 14  4  2  0  0  0  0
 15  7  2  0  0  0  0
 16 17  2  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19  8  1  0  0  0  0
  9 10  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (680)
680

>  <Formula> (680)
C13H13BrN2O3

>  <MolWeight> (680)
325.15792

>  <PCAT_CMPD_ID> (680)
WAY-352100

>  <CNC_ID> (680)
359439781

>  <transfer_container_id> (680)
PTN000000075

>  <COMPOUND_NUMBER> (680)
WAY-352100

>  <BAR_CODE_NO> (680)
2562390

>  <LOCATION_CODE> (680)
PTNCS

>  <AMOUNT_CURRENT> (680)
32.8

$$$$
WAY-352106
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    0.9500   -3.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6667   -4.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3292   -7.6792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1417   -6.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4417   -4.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7792   -3.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8125   -5.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0417   -4.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 15  1  1  0  0  0  0
 16  1  1  0  0  0  0
 17  1  1  0  0  0  0
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 11  4  1  0  0  0  0
  8  6  1  0  0  0  0
M  END
>  <Mol_ID> (681)
681

>  <Formula> (681)
C15H10F3N3O

>  <MolWeight> (681)
305.2546096

>  <PCAT_CMPD_ID> (681)
WAY-352106

>  <CNC_ID> (681)
359439786

>  <transfer_container_id> (681)
PTN000000075

>  <COMPOUND_NUMBER> (681)
WAY-352106

>  <BAR_CODE_NO> (681)
2562463

>  <LOCATION_CODE> (681)
PTNCS

>  <AMOUNT_CURRENT> (681)
32.1

$$$$
WAY-352264
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -4.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  2  0  0  0  0
  7 10  2  0  0  0  0
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  9 12  2  0  0  0  0
 10 11  1  0  0  0  0
 11  4  2  0  0  0  0
 12  5  1  0  0  0  0
 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
 16 17  2  0  0  0  0
 17 14  1  0  0  0  0
  9 16  1  0  0  0  0
  7  6  1  0  0  0  0
M  END
>  <Mol_ID> (682)
682

>  <Formula> (682)
C12H10BrN3O

>  <MolWeight> (682)
292.1313

>  <PCAT_CMPD_ID> (682)
WAY-352264

>  <CNC_ID> (682)
359439944

>  <transfer_container_id> (682)
PTN000000075

>  <COMPOUND_NUMBER> (682)
WAY-352264

>  <BAR_CODE_NO> (682)
2562311

>  <LOCATION_CODE> (682)
PTNCS

>  <AMOUNT_CURRENT> (682)
32.9

$$$$
WAY-352374
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    5.0542   -3.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3417   -2.6042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3417   -4.5667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1875   -2.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1875   -4.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5667   -5.7542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7 10  1  0  0  0  0
  8 12  1  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  2  1  0  0  0  0
 12 16  2  0  0  0  0
 13  7  2  0  0  0  0
 14 25  1  0  0  0  0
 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17  9  1  0  0  0  0
 18 17  1  0  0  0  0
 19 17  2  0  0  0  0
 20  8  1  0  0  0  0
 21  8  1  0  0  0  0
 22  4  2  0  0  0  0
 23  6  2  0  0  0  0
 24 11  1  0  0  0  0
 25 21  1  0  0  0  0
 26 20  1  0  0  0  0
 27 10  1  0  0  0  0
 28 24  1  0  0  0  0
 29 24  1  0  0  0  0
 30 22  1  0  0  0  0
 31 23  1  0  0  0  0
  6  4  1  0  0  0  0
 31 30  2  0  0  0  0
 15 12  1  0  0  0  0
 14 26  1  0  0  0  0
M  END
>  <Mol_ID> (683)
683

>  <Formula> (683)
C24H30N4O2S

>  <MolWeight> (683)
438.5856

>  <PCAT_CMPD_ID> (683)
WAY-352374

>  <CNC_ID> (683)
359440051

>  <transfer_container_id> (683)
PTN000000075

>  <COMPOUND_NUMBER> (683)
WAY-352374

>  <BAR_CODE_NO> (683)
2562661

>  <LOCATION_CODE> (683)
PTNCS

>  <AMOUNT_CURRENT> (683)
32.9

$$$$
WAY-352516
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
    1.8375    0.8625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9292   -1.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3583    0.8833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  5  1  0  0  0  0
 11 18  1  0  0  0  0
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 14  6  2  0  0  0  0
 15  2  1  0  0  0  0
 16  5  1  0  0  0  0
 17  3  2  0  0  0  0
 18 15  1  0  0  0  0
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 20 11  2  0  0  0  0
 21 14  1  0  0  0  0
 22  6  1  0  0  0  0
 23  7  2  0  0  0  0
 24 10  2  0  0  0  0
 25 14  1  0  0  0  0
 26  8  2  0  0  0  0
 27 13  2  0  0  0  0
 28 22  2  0  0  0  0
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 32 24  1  0  0  0  0
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  8  4  1  0  0  0  0
 21 29  2  0  0  0  0
 26 33  1  0  0  0  0
  9 13  1  0  0  0  0
 34 27  1  0  0  0  0
M  END
>  <Mol_ID> (684)
684

>  <Formula> (684)
C26H22N4O3S

>  <MolWeight> (684)
470.54288

>  <PCAT_CMPD_ID> (684)
WAY-352516

>  <CNC_ID> (684)
359440190

>  <transfer_container_id> (684)
PTN000000075

>  <COMPOUND_NUMBER> (684)
WAY-352516

>  <BAR_CODE_NO> (684)
2562781

>  <LOCATION_CODE> (684)
PTNCS

>  <AMOUNT_CURRENT> (684)
32.4

$$$$
WAY-352620
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  2  2  0  0  0  0
 12  1  1  0  0  0  0
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 14  3  1  0  0  0  0
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 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
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  7  3  2  0  0  0  0
M  END
>  <Mol_ID> (685)
685

>  <Formula> (685)
C16H14ClFN2O2

>  <MolWeight> (685)
320.7459632

>  <PCAT_CMPD_ID> (685)
WAY-352620

>  <CNC_ID> (685)
359440288

>  <transfer_container_id> (685)
PTN000000075

>  <COMPOUND_NUMBER> (685)
WAY-352620

>  <BAR_CODE_NO> (685)
2562920

>  <LOCATION_CODE> (685)
PTNCS

>  <AMOUNT_CURRENT> (685)
32.5

$$$$
WAY-352990
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (686)
686

>  <Formula> (686)
C16H14N2O2S2

>  <MolWeight> (686)
330.42456

>  <PCAT_CMPD_ID> (686)
WAY-352990

>  <CNC_ID> (686)
359440647

>  <transfer_container_id> (686)
PTN000000075

>  <COMPOUND_NUMBER> (686)
WAY-352990

>  <BAR_CODE_NO> (686)
2564539

>  <LOCATION_CODE> (686)
PTNCS

>  <AMOUNT_CURRENT> (686)
32.8

$$$$
WAY-353477
csChFnd80/10111816222D

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 11  5  1  0  0  0  0
 12  2  1  0  0  0  0
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 14  3  1  0  0  0  0
 15  5  2  0  0  0  0
 16 13  1  0  0  0  0
 17  6  2  0  0  0  0
 18  8  1  0  0  0  0
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 16  8  1  0  0  0  0
 18 23  2  0  0  0  0
 22 15  1  0  0  0  0
M  END
>  <Mol_ID> (687)
687

>  <Formula> (687)
C21H25NO2

>  <MolWeight> (687)
323.4287

>  <PCAT_CMPD_ID> (687)
WAY-353477

>  <CNC_ID> (687)
359441110

>  <transfer_container_id> (687)
PTN000000075

>  <COMPOUND_NUMBER> (687)
WAY-353477

>  <BAR_CODE_NO> (687)
2563918

>  <LOCATION_CODE> (687)
PTNCS

>  <AMOUNT_CURRENT> (687)
32.9

$$$$
WAY-353559
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 14  6  1  0  0  0  0
 15  4  1  0  0  0  0
 16  6  2  0  0  0  0
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 18 10  2  0  0  0  0
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 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
 24  5  1  0  0  0  0
 13 19  2  0  0  0  0
 11  9  1  0  0  0  0
M  END
>  <Mol_ID> (688)
688

>  <Formula> (688)
C14H19ClN4O4S

>  <MolWeight> (688)
374.84306

>  <PCAT_CMPD_ID> (688)
WAY-353559

>  <CNC_ID> (688)
359441189

>  <transfer_container_id> (688)
PTN000000075

>  <COMPOUND_NUMBER> (688)
WAY-353559

>  <BAR_CODE_NO> (688)
2563947

>  <LOCATION_CODE> (688)
PTNCS

>  <AMOUNT_CURRENT> (688)
32.9

$$$$
WAY-354766
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 12 24  2  0  0  0  0
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M  END
>  <Mol_ID> (689)
689

>  <Formula> (689)
C23H24N2O4S

>  <MolWeight> (689)
424.51266

>  <PCAT_CMPD_ID> (689)
WAY-354766

>  <CNC_ID> (689)
359442330

>  <transfer_container_id> (689)
PTN000000075

>  <COMPOUND_NUMBER> (689)
WAY-354766

>  <BAR_CODE_NO> (689)
2564984

>  <LOCATION_CODE> (689)
PTNCS

>  <AMOUNT_CURRENT> (689)
32.3

$$$$
WAY-267777
csChFnd80/10111816222D

 35 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (690)
690

>  <Formula> (690)
C27H24ClN3O4

>  <MolWeight> (690)
489.95016

>  <PCAT_CMPD_ID> (690)
WAY-267777

>  <CNC_ID> (690)
359442464

>  <transfer_container_id> (690)
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>  <COMPOUND_NUMBER> (690)
WAY-267777

>  <BAR_CODE_NO> (690)
2567189

>  <LOCATION_CODE> (690)
PTNCS

>  <AMOUNT_CURRENT> (690)
32.8

$$$$
WAY-341081-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
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 17 15  1  0  0  0  0
 18  3  1  0  0  0  0
 19  7  1  0  0  0  0
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  3  7  2  0  0  0  0
 21 20  1  0  0  0  0
 12 16  1  0  0  0  0
M  END
>  <Mol_ID> (691)
691

>  <Formula> (691)
C17H17ClN2O

>  <MolWeight> (691)
300.78268

>  <PCAT_CMPD_ID> (691)
WAY-341081-A

>  <CNC_ID> (691)
359442476

>  <transfer_container_id> (691)
PTN000000076

>  <COMPOUND_NUMBER> (691)
WAY-341081-A

>  <BAR_CODE_NO> (691)
2572709

>  <LOCATION_CODE> (691)
PTNCS

>  <AMOUNT_CURRENT> (691)
27.4

$$$$
WAY-354896
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
    3.6917   -3.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 17  1  0  0  0  0
 11  1  1  0  0  0  0
 12  2  2  0  0  0  0
 13  8  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  1  0  0  0  0
 16  7  1  0  0  0  0
 17 16  2  0  0  0  0
 18 11  2  0  0  0  0
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 21 13  1  0  0  0  0
 22 14  1  0  0  0  0
 23 20  1  0  0  0  0
  5  6  1  0  0  0  0
 19 15  2  0  0  0  0
  8 10  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (692)
692

>  <Formula> (692)
C18H16O5

>  <MolWeight> (692)
312.31664

>  <PCAT_CMPD_ID> (692)
WAY-354896

>  <CNC_ID> (692)
359442669

>  <transfer_container_id> (692)
PTN000000076

>  <COMPOUND_NUMBER> (692)
WAY-354896

>  <BAR_CODE_NO> (692)
2565234

>  <LOCATION_CODE> (692)
PTNCS

>  <AMOUNT_CURRENT> (692)
32.5

$$$$
WAY-355485
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  7  1  0  0  0  0
 12  1  2  0  0  0  0
 13  6  2  0  0  0  0
 14  2  1  0  0  0  0
 15 14  2  0  0  0  0
 16 13  1  0  0  0  0
 17  6  1  0  0  0  0
 18 13  1  0  0  0  0
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 20 19  1  0  0  0  0
  5  3  2  0  0  0  0
 10  9  1  0  0  0  0
 20 18  2  0  0  0  0
M  END
>  <Mol_ID> (693)
693

>  <Formula> (693)
C15H11ClO4

>  <MolWeight> (693)
290.69844

>  <PCAT_CMPD_ID> (693)
WAY-355485

>  <CNC_ID> (693)
359443245

>  <transfer_container_id> (693)
PTN000000076

>  <COMPOUND_NUMBER> (693)
WAY-355485

>  <BAR_CODE_NO> (693)
2565771

>  <LOCATION_CODE> (693)
PTNCS

>  <AMOUNT_CURRENT> (693)
32.1

$$$$
WAY-357382
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    0.4542   -1.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12  2  2  0  0  0  0
 13  5  2  0  0  0  0
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 15  3  1  0  0  0  0
 16  1  2  0  0  0  0
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 10 19  1  0  0  0  0
 14 11  2  0  0  0  0
M  END
>  <Mol_ID> (694)
694

>  <Formula> (694)
C15H15NO5

>  <MolWeight> (694)
289.2833

>  <PCAT_CMPD_ID> (694)
WAY-357382

>  <CNC_ID> (694)
359445107

>  <transfer_container_id> (694)
PTN000000076

>  <COMPOUND_NUMBER> (694)
WAY-357382

>  <BAR_CODE_NO> (694)
2566718

>  <LOCATION_CODE> (694)
PTNCS

>  <AMOUNT_CURRENT> (694)
32.1

$$$$
WAY-357941
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 18 19  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (695)
695

>  <Formula> (695)
C15H13N2O4P

>  <MolWeight> (695)
316.248481

>  <PCAT_CMPD_ID> (695)
WAY-357941

>  <CNC_ID> (695)
359445683

>  <transfer_container_id> (695)
PTN000000076

>  <COMPOUND_NUMBER> (695)
WAY-357941

>  <BAR_CODE_NO> (695)
2569065

>  <LOCATION_CODE> (695)
PTNCS

>  <AMOUNT_CURRENT> (695)
32.7

$$$$
WAY-358008
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (696)
696

>  <Formula> (696)
C17H15N3O3S

>  <MolWeight> (696)
341.3843

>  <PCAT_CMPD_ID> (696)
WAY-358008

>  <CNC_ID> (696)
359445748

>  <transfer_container_id> (696)
PTN000000076

>  <COMPOUND_NUMBER> (696)
WAY-358008

>  <BAR_CODE_NO> (696)
2569155

>  <LOCATION_CODE> (696)
PTNCS

>  <AMOUNT_CURRENT> (696)
32.8

$$$$
WAY-358394
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 11  6  2  0  0  0  0
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 16  8  1  0  0  0  0
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 18  7  1  0  0  0  0
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  8  9  2  0  0  0  0
M  END
>  <Mol_ID> (697)
697

>  <Formula> (697)
C14H16N2O4

>  <MolWeight> (697)
276.28784

>  <PCAT_CMPD_ID> (697)
WAY-358394

>  <CNC_ID> (697)
359446118

>  <transfer_container_id> (697)
PTN000000076

>  <COMPOUND_NUMBER> (697)
WAY-358394

>  <BAR_CODE_NO> (697)
2569610

>  <LOCATION_CODE> (697)
PTNCS

>  <AMOUNT_CURRENT> (697)
32.4

$$$$
WAY-358438
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
   -0.9834   -0.3998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 15  3  0  0  0  0
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 16 20  1  0  0  0  0
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 19 20  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (698)
698

>  <Formula> (698)
C22H18ClN5O

>  <MolWeight> (698)
403.86422

>  <PCAT_CMPD_ID> (698)
WAY-358438

>  <CNC_ID> (698)
359446161

>  <transfer_container_id> (698)
PTN000000076

>  <COMPOUND_NUMBER> (698)
WAY-358438

>  <BAR_CODE_NO> (698)
2569633

>  <LOCATION_CODE> (698)
PTNCS

>  <AMOUNT_CURRENT> (698)
32.8

$$$$
WAY-358604
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
   -1.3458    0.7333    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  2  0  0  0  0
 11  1  2  0  0  0  0
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 18  3  2  0  0  0  0
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 21  6  2  0  0  0  0
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 30 28  1  0  0  0  0
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 29 30  2  0  0  0  0
 26 18  1  0  0  0  0
M  END
>  <Mol_ID> (699)
699

>  <Formula> (699)
C21H17F3N2O3S

>  <MolWeight> (699)
434.4314896

>  <PCAT_CMPD_ID> (699)
WAY-358604

>  <CNC_ID> (699)
359446316

>  <transfer_container_id> (699)
PTN000000076

>  <COMPOUND_NUMBER> (699)
WAY-358604

>  <BAR_CODE_NO> (699)
2569803

>  <LOCATION_CODE> (699)
PTNCS

>  <AMOUNT_CURRENT> (699)
32.7

$$$$
WAY-358664
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (700)
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>  <Formula> (700)
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>  <MolWeight> (700)
383.39454

>  <PCAT_CMPD_ID> (700)
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>  <CNC_ID> (700)
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>  <transfer_container_id> (700)
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>  <COMPOUND_NUMBER> (700)
WAY-358664

>  <BAR_CODE_NO> (700)
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>  <LOCATION_CODE> (700)
PTNCS

>  <AMOUNT_CURRENT> (700)
32.4

$$$$
WAY-358677
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13  6  1  0  0  0  0
 14  6  2  0  0  0  0
 15 14  1  0  0  0  0
 16 13  2  0  0  0  0
 17  5  1  0  0  0  0
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 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
  9  8  1  0  0  0  0
 16  7  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (701)
701

>  <Formula> (701)
C17H14N2O3

>  <MolWeight> (701)
294.30466

>  <PCAT_CMPD_ID> (701)
WAY-358677

>  <CNC_ID> (701)
359446387

>  <transfer_container_id> (701)
PTN000000076

>  <COMPOUND_NUMBER> (701)
WAY-358677

>  <BAR_CODE_NO> (701)
2569859

>  <LOCATION_CODE> (701)
PTNCS

>  <AMOUNT_CURRENT> (701)
32.4

$$$$
WAY-358756
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
 12  3  1  0  0  0  0
 13  6  1  0  0  0  0
 14 11  1  0  0  0  0
 15 12  1  0  0  0  0
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 17 14  1  0  0  0  0
 18  7  2  0  0  0  0
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 20  4  1  0  0  0  0
 21  4  1  0  0  0  0
 22  4  1  0  0  0  0
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 29 28  1  0  0  0  0
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 24 25  1  0  0  0  0
 11 15  2  0  0  0  0
M  END
>  <Mol_ID> (702)
702

>  <Formula> (702)
C16H13ClF3N3O5S

>  <MolWeight> (702)
451.8047296

>  <PCAT_CMPD_ID> (702)
WAY-358756

>  <CNC_ID> (702)
359446462

>  <transfer_container_id> (702)
PTN000000076

>  <COMPOUND_NUMBER> (702)
WAY-358756

>  <BAR_CODE_NO> (702)
2569958

>  <LOCATION_CODE> (702)
PTNCS

>  <AMOUNT_CURRENT> (702)
32.9

$$$$
WAY-358799
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  9  2  2  0  0  0  0
 10  3  1  0  0  0  0
 11 10  3  0  0  0  0
 12  5  1  0  0  0  0
 13  4  1  0  0  0  0
 14 12  1  0  0  0  0
 15  9  1  0  0  0  0
 16 14  1  0  0  0  0
 17 14  2  0  0  0  0
 18 16  2  0  0  0  0
 19 17  1  0  0  0  0
 20 19  2  0  0  0  0
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  5  3  1  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (703)
703

>  <Formula> (703)
C15H14N4O

>  <MolWeight> (703)
266.29786

>  <PCAT_CMPD_ID> (703)
WAY-358799

>  <CNC_ID> (703)
359446503

>  <transfer_container_id> (703)
PTN000000076

>  <COMPOUND_NUMBER> (703)
WAY-358799

>  <BAR_CODE_NO> (703)
2569994

>  <LOCATION_CODE> (703)
PTNCS

>  <AMOUNT_CURRENT> (703)
32.5

$$$$
WAY-358823
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
    0.0176   -1.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 17  1  0  0  0  0
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 18 19  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (704)
704

>  <Formula> (704)
C20H22N4S

>  <MolWeight> (704)
350.48048

>  <PCAT_CMPD_ID> (704)
WAY-358823

>  <CNC_ID> (704)
359446525

>  <transfer_container_id> (704)
PTN000000076

>  <COMPOUND_NUMBER> (704)
WAY-358823

>  <BAR_CODE_NO> (704)
2570029

>  <LOCATION_CODE> (704)
PTNCS

>  <AMOUNT_CURRENT> (704)
32.5

$$$$
WAY-359279
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  1  0  0  0  0
 13  8  1  0  0  0  0
 14  9  1  0  0  0  0
 15  5  2  0  0  0  0
 16  4  1  0  0  0  0
 17 18  1  0  0  0  0
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 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
 17 19  2  0  0  0  0
 10 14  2  0  0  0  0
M  END
>  <Mol_ID> (705)
705

>  <Formula> (705)
C18H22N2O2S

>  <MolWeight> (705)
330.44448

>  <PCAT_CMPD_ID> (705)
WAY-359279

>  <CNC_ID> (705)
359446971

>  <transfer_container_id> (705)
PTN000000076

>  <COMPOUND_NUMBER> (705)
WAY-359279

>  <BAR_CODE_NO> (705)
2570521

>  <LOCATION_CODE> (705)
PTNCS

>  <AMOUNT_CURRENT> (705)
32.4

$$$$
WAY-359029
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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  6  7  1  0  0  0  0
  7  5  2  0  0  0  0
  8  4  2  0  0  0  0
  9  4  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14  9  1  0  0  0  0
 15 13  1  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18 12  1  0  0  0  0
 19 14  1  0  0  0  0
  3  6  2  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (706)
706

>  <Formula> (706)
C14H18O5

>  <MolWeight> (706)
266.28972

>  <PCAT_CMPD_ID> (706)
WAY-359029

>  <CNC_ID> (706)
359446732

>  <transfer_container_id> (706)
PTN000000076

>  <COMPOUND_NUMBER> (706)
WAY-359029

>  <BAR_CODE_NO> (706)
2570244

>  <LOCATION_CODE> (706)
PTNCS

>  <AMOUNT_CURRENT> (706)
32.2

$$$$
WAY-359098
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   -1.7708   -1.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  2  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  5  1  0  0  0  0
 13 12  1  0  0  0  0
 14 10  1  0  0  0  0
 15 13  2  0  0  0  0
 16  4  2  0  0  0  0
 17 10  2  0  0  0  0
 18 11  2  0  0  0  0
 19 12  2  0  0  0  0
 20 21  2  0  0  0  0
 21 19  1  0  0  0  0
 22  8  1  0  0  0  0
 23 15  1  0  0  0  0
 24 20  1  0  0  0  0
 25 14  1  0  0  0  0
 26 23  1  0  0  0  0
 27 25  1  0  0  0  0
 28 25  1  0  0  0  0
  8  9  1  0  0  0  0
  6 11  1  0  0  0  0
 20 15  1  0  0  0  0
M  END
>  <Mol_ID> (707)
707

>  <Formula> (707)
C19H21N3O6

>  <MolWeight> (707)
387.38654

>  <PCAT_CMPD_ID> (707)
WAY-359098

>  <CNC_ID> (707)
359446799

>  <transfer_container_id> (707)
PTN000000076

>  <COMPOUND_NUMBER> (707)
WAY-359098

>  <BAR_CODE_NO> (707)
2570320

>  <LOCATION_CODE> (707)
PTNCS

>  <AMOUNT_CURRENT> (707)
32.1

$$$$
WAY-359303
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
    1.3500   -3.3292    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  2  0  0  0  0
  8  2  1  0  0  0  0
  9  3  1  0  0  0  0
 10  5  1  0  0  0  0
 11  1  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
 14 10  1  0  0  0  0
 15 21  1  0  0  0  0
 16  6  1  0  0  0  0
 17 15  1  0  0  0  0
 18  7  1  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
 21 20  2  0  0  0  0
 22 19  1  0  0  0  0
 23 11  2  0  0  0  0
 24 11  1  0  0  0  0
 25 16  2  0  0  0  0
 26 25  1  0  0  0  0
 27 24  2  0  0  0  0
 28 23  1  0  0  0  0
 29 27  1  0  0  0  0
  4  7  1  0  0  0  0
  9  8  1  0  0  0  0
 28 29  2  0  0  0  0
 26 18  2  0  0  0  0
 22 15  2  0  0  0  0
M  END
>  <Mol_ID> (708)
708

>  <Formula> (708)
C23H18FN3O2

>  <MolWeight> (708)
387.4063232

>  <PCAT_CMPD_ID> (708)
WAY-359303

>  <CNC_ID> (708)
359446994

>  <transfer_container_id> (708)
PTN000000076

>  <COMPOUND_NUMBER> (708)
WAY-359303

>  <BAR_CODE_NO> (708)
2570545

>  <LOCATION_CODE> (708)
PTNCS

>  <AMOUNT_CURRENT> (708)
32.5

$$$$
WAY-359304
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    4.2917   -3.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625   -3.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
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  8  1  1  0  0  0  0
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 10  8  3  0  0  0  0
 11  7  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  2  0  0  0  0
 14 11  1  0  0  0  0
 15  5  1  0  0  0  0
 16  9  1  0  0  0  0
 17 15  1  0  0  0  0
 18 11  1  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
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 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
  2  5  2  0  0  0  0
 16 17  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (709)
709

>  <Formula> (709)
C19H20N2O2

>  <MolWeight> (709)
308.3743

>  <PCAT_CMPD_ID> (709)
WAY-359304

>  <CNC_ID> (709)
359446995

>  <transfer_container_id> (709)
PTN000000076

>  <COMPOUND_NUMBER> (709)
WAY-359304

>  <BAR_CODE_NO> (709)
2570541

>  <LOCATION_CODE> (709)
PTNCS

>  <AMOUNT_CURRENT> (709)
33

$$$$
WAY-359307
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  3  4  1  0  0  0  0
 10 11  1  0  0  0  0
  4  5  1  0  0  0  0
 11 12  1  0  0  0  0
  5  6  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
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 14 15  2  0  0  0  0
  1  2  1  0  0  0  0
 15 16  1  0  0  0  0
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 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1  6  1  0  0  0  0
  8 18  2  0  0  0  0
M  END
>  <Mol_ID> (710)
710

>  <Formula> (710)
C15H22N2O

>  <MolWeight> (710)
246.34798

>  <PCAT_CMPD_ID> (710)
WAY-359307

>  <CNC_ID> (710)
359446998

>  <transfer_container_id> (710)
PTN000000076

>  <COMPOUND_NUMBER> (710)
WAY-359307

>  <BAR_CODE_NO> (710)
2570546

>  <LOCATION_CODE> (710)
PTNCS

>  <AMOUNT_CURRENT> (710)
32.2

$$$$
WAY-359497
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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   -1.2554    1.4993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  2  5  2  0  0  0  0
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  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
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 16 18  2  0  0  0  0
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 18 20  1  0  0  0  0
  7  8  1  0  0  0  0
 10 12  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (711)
711

>  <Formula> (711)
C15H12N4O

>  <MolWeight> (711)
264.28198

>  <PCAT_CMPD_ID> (711)
WAY-359497

>  <CNC_ID> (711)
359447182

>  <transfer_container_id> (711)
PTN000000076

>  <COMPOUND_NUMBER> (711)
WAY-359497

>  <BAR_CODE_NO> (711)
2570760

>  <LOCATION_CODE> (711)
PTNCS

>  <AMOUNT_CURRENT> (711)
32.7

$$$$
WAY-359511
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -0.5868    0.2106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1994   -0.6273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8408   -0.5066    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  2  0  0  0  0
  7 16  1  0  0  0  0
  8 17  2  0  0  0  0
 14 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7 11  2  0  0  0  0
  9 17  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (712)
712

>  <Formula> (712)
C18H22N4OS2

>  <MolWeight> (712)
374.52348

>  <PCAT_CMPD_ID> (712)
WAY-359511

>  <CNC_ID> (712)
359447196

>  <transfer_container_id> (712)
PTN000000076

>  <COMPOUND_NUMBER> (712)
WAY-359511

>  <BAR_CODE_NO> (712)
2570781

>  <LOCATION_CODE> (712)
PTNCS

>  <AMOUNT_CURRENT> (712)
32.5

$$$$
WAY-359515
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   -1.5046    0.7106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5630    1.7736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8960   -0.7374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0035    0.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4041   -0.0596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 23 22  2  0  0  0  0
  6  8  2  0  0  0  0
 23 21  1  0  0  0  0
 22 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 18  2  0  0  0  0
 19 18  1  0  0  0  0
 18 16  1  0  0  0  0
 17 13  1  0  0  0  0
 16 11  1  0  0  0  0
 15 10  1  0  0  0  0
 14  9  1  0  0  0  0
 13  8  1  0  0  0  0
 12  7  2  0  0  0  0
 11  7  1  0  0  0  0
 10  6  1  0  0  0  0
  9  5  1  0  0  0  0
  8  5  1  0  0  0  0
  7  4  1  0  0  0  0
  6  3  1  0  0  0  0
  5  2  2  0  0  0  0
  4  1  1  0  0  0  0
  1  3  2  0  0  0  0
  2  1  1  0  0  0  0
M  END
>  <Mol_ID> (713)
713

>  <Formula> (713)
C16H19N3O4

>  <MolWeight> (713)
317.33976

>  <PCAT_CMPD_ID> (713)
WAY-359515

>  <CNC_ID> (713)
359447200

>  <transfer_container_id> (713)
PTN000000076

>  <COMPOUND_NUMBER> (713)
WAY-359515

>  <BAR_CODE_NO> (713)
2570775

>  <LOCATION_CODE> (713)
PTNCS

>  <AMOUNT_CURRENT> (713)
32.5

$$$$
WAY-359529
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    2.4417   -2.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1667   -1.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  7  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  4  1  0  0  0  0
  9  6  1  0  0  0  0
 10  3  2  0  0  0  0
 11  6  2  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14  2  1  0  0  0  0
 15  2  1  0  0  0  0
 16  9  1  0  0  0  0
 17  5  1  0  0  0  0
 18 16  1  0  0  0  0
 19 16  2  0  0  0  0
 20 14  1  0  0  0  0
 21 15  1  0  0  0  0
 22 19  1  0  0  0  0
 23 18  2  0  0  0  0
 24 22  2  0  0  0  0
 25 21  1  0  0  0  0
  3  4  1  0  0  0  0
 20 25  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (714)
714

>  <Formula> (714)
C19H23N3O2S

>  <MolWeight> (714)
357.46982

>  <PCAT_CMPD_ID> (714)
WAY-359529

>  <CNC_ID> (714)
359447214

>  <transfer_container_id> (714)
PTN000000076

>  <COMPOUND_NUMBER> (714)
WAY-359529

>  <BAR_CODE_NO> (714)
2570803

>  <LOCATION_CODE> (714)
PTNCS

>  <AMOUNT_CURRENT> (714)
32.2

$$$$
WAY-359534
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    3.7210   -0.5334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7210    0.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5934   -1.1472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.3618    1.4908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 18 21  2  0  0  0  0
 21 22  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (715)
715

>  <Formula> (715)
C18H14O4

>  <MolWeight> (715)
294.30136

>  <PCAT_CMPD_ID> (715)
WAY-359534

>  <CNC_ID> (715)
359447219

>  <transfer_container_id> (715)
PTN000000076

>  <COMPOUND_NUMBER> (715)
WAY-359534

>  <BAR_CODE_NO> (715)
2570795

>  <LOCATION_CODE> (715)
PTNCS

>  <AMOUNT_CURRENT> (715)
29

$$$$
WAY-359600
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
    6.0000  -15.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3167  -15.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6792  -15.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.0375  -15.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4 11  1  0  0  0  0
  5  2  2  0  0  0  0
  6  3  2  0  0  0  0
  7  4  1  0  0  0  0
  8  7  2  0  0  0  0
  9  1  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 13  1  0  0  0  0
 15  3  1  0  0  0  0
 16  2  1  0  0  0  0
 17  6  1  0  0  0  0
 18  5  1  0  0  0  0
 19  7  1  0  0  0  0
 20 23  1  0  0  0  0
 21 22  1  0  0  0  0
 22 16  2  0  0  0  0
 23 15  2  0  0  0  0
  6  5  1  0  0  0  0
 20 17  2  0  0  0  0
 18 21  2  0  0  0  0
  8 10  1  0  0  0  0
M  END
>  <Mol_ID> (716)
716

>  <Formula> (716)
C19H19N3O

>  <MolWeight> (716)
305.37366

>  <PCAT_CMPD_ID> (716)
WAY-359600

>  <CNC_ID> (716)
359447282

>  <transfer_container_id> (716)
PTN000000076

>  <COMPOUND_NUMBER> (716)
WAY-359600

>  <BAR_CODE_NO> (716)
2570864

>  <LOCATION_CODE> (716)
PTNCS

>  <AMOUNT_CURRENT> (716)
32.6

$$$$
WAY-359647-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.4417   -7.3917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2042   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6167   -7.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4417   -5.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9292   -8.8167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1875  -10.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1750   -9.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6000  -10.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2000  -12.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9625   -5.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8 11  1  0  0  0  0
  9  5  1  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12 16  1  0  0  0  0
 13 10  2  0  0  0  0
 14 10  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  2  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
 19  2  2  0  0  0  0
 20  4  2  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
  2  4  1  0  0  0  0
 22 23  2  0  0  0  0
 15 12  2  0  0  0  0
M  END
>  <Mol_ID> (717)
717

>  <Formula> (717)
C19H23NO3

>  <MolWeight> (717)
313.39082

>  <PCAT_CMPD_ID> (717)
WAY-359647-A

>  <CNC_ID> (717)
359447329

>  <transfer_container_id> (717)
PTN000000076

>  <COMPOUND_NUMBER> (717)
WAY-359647-A

>  <BAR_CODE_NO> (717)
2570921

>  <LOCATION_CODE> (717)
PTNCS

>  <AMOUNT_CURRENT> (717)
32.6

$$$$
WAY-359917
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    4.3417   -1.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7667   -2.5875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3542   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4917   -0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  8  1  0  0  0  0
  6 14  1  0  0  0  0
  7 13  1  0  0  0  0
  8  7  2  0  0  0  0
  9 10  2  0  0  0  0
 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
 12  6  2  0  0  0  0
 13  6  1  0  0  0  0
 14 15  1  0  0  0  0
 15  3  1  0  0  0  0
 16  4  1  0  0  0  0
 17  1  1  0  0  0  0
 18  4  1  0  0  0  0
 19 16  1  0  0  0  0
 20 16  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 18 22  2  0  0  0  0
  5  9  1  0  0  0  0
M  END
>  <Mol_ID> (718)
718

>  <Formula> (718)
C17H19NO3S

>  <MolWeight> (718)
317.40266

>  <PCAT_CMPD_ID> (718)
WAY-359917

>  <CNC_ID> (718)
359447594

>  <transfer_container_id> (718)
PTN000000076

>  <COMPOUND_NUMBER> (718)
WAY-359917

>  <BAR_CODE_NO> (718)
2571157

>  <LOCATION_CODE> (718)
PTNCS

>  <AMOUNT_CURRENT> (718)
32.9

$$$$
WAY-380134
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    2.0417   -1.0917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8  5  2  0  0  0  0
  9  2  1  0  0  0  0
 10  7  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13 10  1  0  0  0  0
 14 12  1  0  0  0  0
 15  6  2  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18  3  1  0  0  0  0
 19  8  1  0  0  0  0
  8  4  1  0  0  0  0
 14 13  2  0  0  0  0
M  END
>  <Mol_ID> (719)
719

>  <Formula> (719)
C12H13N3O3S

>  <MolWeight> (719)
279.31492

>  <PCAT_CMPD_ID> (719)
WAY-380134

>  <CNC_ID> (719)
359447814

>  <transfer_container_id> (719)
PTN000000076

>  <COMPOUND_NUMBER> (719)
WAY-380134

>  <BAR_CODE_NO> (719)
2571415

>  <LOCATION_CODE> (719)
PTNCS

>  <AMOUNT_CURRENT> (719)
32.3

$$$$
WAY-380153
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    2.0929    0.3296    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6520    0.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5933    0.8365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
  8 10  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (720)
720

>  <Formula> (720)
C12H14ClNO2S

>  <MolWeight> (720)
271.76306

>  <PCAT_CMPD_ID> (720)
WAY-380153

>  <CNC_ID> (720)
359447832

>  <transfer_container_id> (720)
PTN000000076

>  <COMPOUND_NUMBER> (720)
WAY-380153

>  <BAR_CODE_NO> (720)
2571435

>  <LOCATION_CODE> (720)
PTNCS

>  <AMOUNT_CURRENT> (720)
32.8

$$$$
WAY-380154
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    8.3750   -7.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7792   -7.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.7875   -6.4792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8417   -8.7292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6667   -6.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0167   -8.6375    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  1  2  0  0  0  0
  5 10  1  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8 15  2  0  0  0  0
  9  2  1  0  0  0  0
 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14 12  2  0  0  0  0
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 16  5  1  0  0  0  0
 17 10  1  0  0  0  0
 18 17  1  0  0  0  0
 14  8  1  0  0  0  0
 18 16  1  0  0  0  0
M  END
>  <Mol_ID> (721)
721

>  <Formula> (721)
C13H16ClNO2S

>  <MolWeight> (721)
285.78964

>  <PCAT_CMPD_ID> (721)
WAY-380154

>  <CNC_ID> (721)
359447833

>  <transfer_container_id> (721)
PTN000000076

>  <COMPOUND_NUMBER> (721)
WAY-380154

>  <BAR_CODE_NO> (721)
2571436

>  <LOCATION_CODE> (721)
PTNCS

>  <AMOUNT_CURRENT> (721)
32.4

$$$$
WAY-380232
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    3.6875   -5.8792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.3167   -3.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  2  1  0  0  0  0
  4  6  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8 10  2  0  0  0  0
  9  7  1  0  0  0  0
 10  1  1  0  0  0  0
 11  3  2  0  0  0  0
 12 11  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  5  1  0  0  0  0
 16  2  2  0  0  0  0
 17 15  2  0  0  0  0
 18 15  1  0  0  0  0
 19  9  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  2  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
  4  8  1  0  0  0  0
 20 22  2  0  0  0  0
  9 12  2  0  0  0  0
M  END
>  <Mol_ID> (722)
722

>  <Formula> (722)
C16H14BrNO4S

>  <MolWeight> (722)
396.25566

>  <PCAT_CMPD_ID> (722)
WAY-380232

>  <CNC_ID> (722)
359447910

>  <transfer_container_id> (722)
PTN000000076

>  <COMPOUND_NUMBER> (722)
WAY-380232

>  <BAR_CODE_NO> (722)
2571537

>  <LOCATION_CODE> (722)
PTNCS

>  <AMOUNT_CURRENT> (722)
32.6

$$$$
WAY-380234
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
   -0.2583   -1.9167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.5417   -1.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0500   -2.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3833   -2.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1708   -1.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5125   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7 13  1  0  0  0  0
  8  2  1  0  0  0  0
  9  2  1  0  0  0  0
 10  3  2  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15  7  1  0  0  0  0
 16 17  1  0  0  0  0
 17 15  1  0  0  0  0
 12 11  2  0  0  0  0
 14  7  1  0  0  0  0
M  END
>  <Mol_ID> (723)
723

>  <Formula> (723)
C10H16N2O3S2

>  <MolWeight> (723)
276.37564

>  <PCAT_CMPD_ID> (723)
WAY-380234

>  <CNC_ID> (723)
359447912

>  <transfer_container_id> (723)
PTN000000076

>  <COMPOUND_NUMBER> (723)
WAY-380234

>  <BAR_CODE_NO> (723)
2571539

>  <LOCATION_CODE> (723)
PTNCS

>  <AMOUNT_CURRENT> (723)
32.8

$$$$
WAY-380329
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    8.2667   -7.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8792   -8.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7042   -8.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6625   -7.9542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6875   -9.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0375   -9.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3917   -9.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7292   -6.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 10  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8 11  1  0  0  0  0
  9  1  2  0  0  0  0
 10  4  1  0  0  0  0
 11  1  1  0  0  0  0
 12  8  1  0  0  0  0
 13 17  1  0  0  0  0
 14 12  2  0  0  0  0
 15 12  1  0  0  0  0
 16 14  1  0  0  0  0
 17 15  2  0  0  0  0
 18 13  1  0  0  0  0
 13 16  2  0  0  0  0
  6  7  2  0  0  0  0
M  END
>  <Mol_ID> (724)
724

>  <Formula> (724)
C14H15NO2S

>  <MolWeight> (724)
261.3394

>  <PCAT_CMPD_ID> (724)
WAY-380329

>  <CNC_ID> (724)
359448007

>  <transfer_container_id> (724)
PTN000000076

>  <COMPOUND_NUMBER> (724)
WAY-380329

>  <BAR_CODE_NO> (724)
2571629

>  <LOCATION_CODE> (724)
PTNCS

>  <AMOUNT_CURRENT> (724)
32.7

$$$$
WAY-380333
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
    6.8417   -6.3375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1292   -5.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8417   -7.1625    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    5.4167   -7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9875   -7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  6  1  0  0  0  0
  8  4  1  0  0  0  0
  9  6  2  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12  2  2  0  0  0  0
 13  5  1  0  0  0  0
 14  8  1  0  0  0  0
 15 10  1  0  0  0  0
 16 13  2  0  0  0  0
 17 14  2  0  0  0  0
  5  8  2  0  0  0  0
 11 10  2  0  0  0  0
 17 16  1  0  0  0  0
M  END
>  <Mol_ID> (725)
725

>  <Formula> (725)
C13H12N2OS

>  <MolWeight> (725)
244.31218

>  <PCAT_CMPD_ID> (725)
WAY-380333

>  <CNC_ID> (725)
359448011

>  <transfer_container_id> (725)
PTN000000076

>  <COMPOUND_NUMBER> (725)
WAY-380333

>  <BAR_CODE_NO> (725)
2571638

>  <LOCATION_CODE> (725)
PTNCS

>  <AMOUNT_CURRENT> (725)
32.4

$$$$
WAY-380398
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  7  1  0  0  0  0
  7 20  1  0  0  0  0
  8 16  1  0  0  0  0
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 10  6  1  0  0  0  0
 11  9  1  0  0  0  0
 12  8  1  0  0  0  0
 13  2  2  0  0  0  0
 14  3  2  0  0  0  0
 15 12  1  0  0  0  0
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 19 11  2  0  0  0  0
 20 21  2  0  0  0  0
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 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
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 25 10  1  0  0  0  0
 26 12  1  0  0  0  0
 27 23  2  0  0  0  0
 28 22  2  0  0  0  0
  5  4  2  0  0  0  0
 27 28  1  0  0  0  0
  8  7  2  0  0  0  0
 15 10  1  0  0  0  0
M  END
>  <Mol_ID> (726)
726

>  <Formula> (726)
C22H22N2O4

>  <MolWeight> (726)
378.42108

>  <PCAT_CMPD_ID> (726)
WAY-380398

>  <CNC_ID> (726)
359448076

>  <transfer_container_id> (726)
PTN000000076

>  <COMPOUND_NUMBER> (726)
WAY-380398

>  <BAR_CODE_NO> (726)
2571705

>  <LOCATION_CODE> (726)
PTNCS

>  <AMOUNT_CURRENT> (726)
32.1

$$$$
WAY-380401
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  1  1  0  0  0  0
 12  8  1  0  0  0  0
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  7  6  2  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <Mol_ID> (727)
727

>  <Formula> (727)
C13H13NO2S

>  <MolWeight> (727)
247.31282

>  <PCAT_CMPD_ID> (727)
WAY-380401

>  <CNC_ID> (727)
359448079

>  <transfer_container_id> (727)
PTN000000076

>  <COMPOUND_NUMBER> (727)
WAY-380401

>  <BAR_CODE_NO> (727)
2571697

>  <LOCATION_CODE> (727)
PTNCS

>  <AMOUNT_CURRENT> (727)
32.1

$$$$
WAY-380402
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 13  5  1  0  0  0  0
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 29  9  1  0  0  0  0
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 21 28  1  0  0  0  0
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 16 32  1  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (728)
728

>  <Formula> (728)
C24H24FN3O5S

>  <MolWeight> (728)
485.5278632

>  <PCAT_CMPD_ID> (728)
WAY-380402

>  <CNC_ID> (728)
359448080

>  <transfer_container_id> (728)
PTN000000076

>  <COMPOUND_NUMBER> (728)
WAY-380402

>  <BAR_CODE_NO> (728)
2571699

>  <LOCATION_CODE> (728)
PTNCS

>  <AMOUNT_CURRENT> (728)
32.7

$$$$
WAY-380407
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
 12  5  1  0  0  0  0
 13  6  2  0  0  0  0
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (729)
729

>  <Formula> (729)
C24H24N2O5

>  <MolWeight> (729)
420.45776

>  <PCAT_CMPD_ID> (729)
WAY-380407

>  <CNC_ID> (729)
359448085

>  <transfer_container_id> (729)
PTN000000076

>  <COMPOUND_NUMBER> (729)
WAY-380407

>  <BAR_CODE_NO> (729)
2571713

>  <LOCATION_CODE> (729)
PTNCS

>  <AMOUNT_CURRENT> (729)
33

$$$$
WAY-380429
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  2  1  0  0  0  0
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 15  9  2  0  0  0  0
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M  END
>  <Mol_ID> (730)
730

>  <Formula> (730)
C19H28N2O2

>  <MolWeight> (730)
316.43782

>  <PCAT_CMPD_ID> (730)
WAY-380429

>  <CNC_ID> (730)
359448107

>  <transfer_container_id> (730)
PTN000000076

>  <COMPOUND_NUMBER> (730)
WAY-380429

>  <BAR_CODE_NO> (730)
2571739

>  <LOCATION_CODE> (730)
PTNCS

>  <AMOUNT_CURRENT> (730)
32.7

$$$$
WAY-380844
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (731)
731

>  <Formula> (731)
C18H15NO4

>  <MolWeight> (731)
309.316

>  <PCAT_CMPD_ID> (731)
WAY-380844

>  <CNC_ID> (731)
359448519

>  <transfer_container_id> (731)
PTN000000076

>  <COMPOUND_NUMBER> (731)
WAY-380844

>  <BAR_CODE_NO> (731)
2568263

>  <LOCATION_CODE> (731)
PTNCS

>  <AMOUNT_CURRENT> (731)
32.8

$$$$
WAY-381328
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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    1.5667   -2.5167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0000   -2.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0667   -5.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2750   -2.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6000   -3.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4 10  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10 11  2  0  0  0  0
 11  3  1  0  0  0  0
 12 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14  2  1  0  0  0  0
 15  2  1  0  0  0  0
 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
 18  7  1  0  0  0  0
 19 14  1  0  0  0  0
 20 15  1  0  0  0  0
 21 18  1  0  0  0  0
 22 17  1  0  0  0  0
  6  4  2  0  0  0  0
 19 12  1  0  0  0  0
 22 13  1  0  0  0  0
M  END
>  <Mol_ID> (732)
732

>  <Formula> (732)
C14H21N3O4S

>  <MolWeight> (732)
327.39924

>  <PCAT_CMPD_ID> (732)
WAY-381328

>  <CNC_ID> (732)
359449003

>  <transfer_container_id> (732)
PTN000000076

>  <COMPOUND_NUMBER> (732)
WAY-381328

>  <BAR_CODE_NO> (732)
2572713

>  <LOCATION_CODE> (732)
PTNCS

>  <AMOUNT_CURRENT> (732)
32.2

$$$$
WAY-381332
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    1.7585   -0.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0752   -1.1447    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4415    0.7053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0790    1.3095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4377   -1.1697    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4502   -0.0155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0998    0.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0373   -0.5530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1665   -0.5155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5 10  1  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  1  1  0  0  0  0
  9  3  1  0  0  0  0
 10 12  1  0  0  0  0
 11  8  1  0  0  0  0
 12 14  1  0  0  0  0
 13  7  2  0  0  0  0
 14  4  1  0  0  0  0
 15  7  1  0  0  0  0
 16  5  2  0  0  0  0
 17 10  2  0  0  0  0
 18 19  2  0  0  0  0
 19 17  1  0  0  0  0
  9 11  2  0  0  0  0
  4  6  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (733)
733

>  <Formula> (733)
C13H10N2O2S2

>  <MolWeight> (733)
290.3607

>  <PCAT_CMPD_ID> (733)
WAY-381332

>  <CNC_ID> (733)
359449007

>  <transfer_container_id> (733)
PTN000000076

>  <COMPOUND_NUMBER> (733)
WAY-381332

>  <BAR_CODE_NO> (733)
2572400

>  <LOCATION_CODE> (733)
PTNCS

>  <AMOUNT_CURRENT> (733)
32.4

$$$$
WAY-381347
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    1.9292    0.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1750   -0.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6042    0.3208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4875    1.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0042    1.9333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6250   -1.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0125    1.9583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0708    3.8583    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    5.0792   -1.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3500   -4.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 10  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  2  2  0  0  0  0
  7  3  2  0  0  0  0
  8  3  1  0  0  0  0
  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11 12  1  0  0  0  0
 12  8  2  0  0  0  0
 13  7  1  0  0  0  0
 14 11  1  0  0  0  0
 15  9  1  0  0  0  0
 16 17  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19 16  2  0  0  0  0
 20 18  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  2  0  0  0  0
 13 11  2  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (734)
734

>  <Formula> (734)
C17H16BrNO3

>  <MolWeight> (734)
362.21784

>  <PCAT_CMPD_ID> (734)
WAY-381347

>  <CNC_ID> (734)
359449022

>  <transfer_container_id> (734)
PTN000000076

>  <COMPOUND_NUMBER> (734)
WAY-381347

>  <BAR_CODE_NO> (734)
2571807

>  <LOCATION_CODE> (734)
PTNCS

>  <AMOUNT_CURRENT> (734)
32.6

$$$$
WAY-381361
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
    9.2667   -9.8875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.7667   -8.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3500   -7.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5167   -6.3417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6917  -10.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8417   -9.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6000   -8.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1000   -5.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0167   -9.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3  2  1  0  0  0  0
  4 15  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  9  1  0  0  0  0
  8  4  1  0  0  0  0
  9  6  2  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  3  1  0  0  0  0
 13  3  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16  2  2  0  0  0  0
 17  8  2  0  0  0  0
 18  5  1  0  0  0  0
 19 22  1  0  0  0  0
 20 18  2  0  0  0  0
 21 18  1  0  0  0  0
 22 21  2  0  0  0  0
 23 20  1  0  0  0  0
 24 27  1  0  0  0  0
 25  6  1  0  0  0  0
 26  8  1  0  0  0  0
 27 25  2  0  0  0  0
 28 19  1  0  0  0  0
  7 24  2  0  0  0  0
 19 23  2  0  0  0  0
 14  4  1  0  0  0  0
M  END
>  <Mol_ID> (735)
735

>  <Formula> (735)
C20H23N3O4S

>  <MolWeight> (735)
401.47932

>  <PCAT_CMPD_ID> (735)
WAY-381361

>  <CNC_ID> (735)
359449036

>  <transfer_container_id> (735)
PTN000000076

>  <COMPOUND_NUMBER> (735)
WAY-381361

>  <BAR_CODE_NO> (735)
2571831

>  <LOCATION_CODE> (735)
PTNCS

>  <AMOUNT_CURRENT> (735)
32.6

$$$$
WAY-381581
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    2.2918   -0.0858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1228   -0.4375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3746    0.8142    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5159   -0.5444    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2539    1.0107    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6159    0.1556    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0427   -0.5651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6082   -0.5893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  5  6  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (736)
736

>  <Formula> (736)
C11H13N5OS

>  <MolWeight> (736)
263.31882

>  <PCAT_CMPD_ID> (736)
WAY-381581

>  <CNC_ID> (736)
359449251

>  <transfer_container_id> (736)
PTN000000076

>  <COMPOUND_NUMBER> (736)
WAY-381581

>  <BAR_CODE_NO> (736)
2572012

>  <LOCATION_CODE> (736)
PTNCS

>  <AMOUNT_CURRENT> (736)
32.7

$$$$
WAY-381583
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    1.8917   -1.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4917   -1.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4250   -0.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7125   -0.8375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1667   -1.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1292   -5.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2792   -3.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6625   -5.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6 10  1  0  0  0  0
  7  1  1  0  0  0  0
  8  6  2  0  0  0  0
  9  6  1  0  0  0  0
 10  7  1  0  0  0  0
 11 14  1  0  0  0  0
 12 19  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 12  2  0  0  0  0
 16 12  1  0  0  0  0
 17  9  1  0  0  0  0
 18 11  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
  4  5  2  0  0  0  0
 13 11  2  0  0  0  0
M  END
>  <Mol_ID> (737)
737

>  <Formula> (737)
C13H16N4O2S

>  <MolWeight> (737)
292.35674

>  <PCAT_CMPD_ID> (737)
WAY-381583

>  <CNC_ID> (737)
359449253

>  <transfer_container_id> (737)
PTN000000076

>  <COMPOUND_NUMBER> (737)
WAY-381583

>  <BAR_CODE_NO> (737)
2572014

>  <LOCATION_CODE> (737)
PTNCS

>  <AMOUNT_CURRENT> (737)
32.8

$$$$
WAY-381610
csChFnd80/10111816222D

 24 28  0  0  0  0  0  0  0  0999 V2000
    1.6075   -0.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
 17 18  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (738)
738

>  <Formula> (738)
C19H22N2O2S

>  <MolWeight> (738)
342.45518

>  <PCAT_CMPD_ID> (738)
WAY-381610

>  <CNC_ID> (738)
359449279

>  <transfer_container_id> (738)
PTN000000076

>  <COMPOUND_NUMBER> (738)
WAY-381610

>  <BAR_CODE_NO> (738)
2572059

>  <LOCATION_CODE> (738)
PTNCS

>  <AMOUNT_CURRENT> (738)
32.5

$$$$
WAY-381696
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
    6.0500   -1.0375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.6417   -1.2542    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    3.4000   -3.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6000   -0.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  9  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  4  1  0  0  0  0
 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
 12 11  1  0  0  0  0
 13  6  1  0  0  0  0
 14  1  1  0  0  0  0
 15  1  2  0  0  0  0
 16  1  2  0  0  0  0
 17 10  2  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20  6  1  0  0  0  0
 21  7  2  0  0  0  0
 22  8  2  0  0  0  0
 23 18  2  0  0  0  0
 24 19  1  0  0  0  0
 25 24  2  0  0  0  0
 26 21  1  0  0  0  0
 27 22  1  0  0  0  0
 28 17  1  0  0  0  0
 29 26  2  0  0  0  0
 30 25  1  0  0  0  0
 25 23  1  0  0  0  0
  8 10  1  0  0  0  0
 29 17  1  0  0  0  0
 28 27  2  0  0  0  0
 13 12  2  0  0  0  0
M  END
>  <Mol_ID> (739)
739

>  <Formula> (739)
C22H20N4O2S2

>  <MolWeight> (739)
436.5498

>  <PCAT_CMPD_ID> (739)
WAY-381696

>  <CNC_ID> (739)
359449364

>  <transfer_container_id> (739)
PTN000000076

>  <COMPOUND_NUMBER> (739)
WAY-381696

>  <BAR_CODE_NO> (739)
2572224

>  <LOCATION_CODE> (739)
PTNCS

>  <AMOUNT_CURRENT> (739)
32.7

$$$$
WAY-381875
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    4.5042   -4.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  9  2  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  1  1  0  0  0  0
 10  8  2  0  0  0  0
 11  4  1  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  2  1  0  0  0  0
 15 11  2  0  0  0  0
 16 11  1  0  0  0  0
 17  7  1  0  0  0  0
 18  8  1  0  0  0  0
 19  9  1  0  0  0  0
 20 16  2  0  0  0  0
 21 15  1  0  0  0  0
 22 20  1  0  0  0  0
 23 10  1  0  0  0  0
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 25 18  2  0  0  0  0
 26 25  1  0  0  0  0
  6  4  1  0  0  0  0
 10  7  1  0  0  0  0
 23 26  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (740)
740

>  <Formula> (740)
C20H20N4O2

>  <MolWeight> (740)
348.3984

>  <PCAT_CMPD_ID> (740)
WAY-381875

>  <CNC_ID> (740)
359449534

>  <transfer_container_id> (740)
PTN000000076

>  <COMPOUND_NUMBER> (740)
WAY-381875

>  <BAR_CODE_NO> (740)
2572316

>  <LOCATION_CODE> (740)
PTNCS

>  <AMOUNT_CURRENT> (740)
32.5

$$$$
WAY-381920
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    3.8917   -8.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  0  0  0  0
  3  6  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  2  0  0  0  0
  7  3  2  0  0  0  0
  8 13  1  0  0  0  0
  9  1  1  0  0  0  0
 10  6  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  2  0  0  0  0
 13 16  1  0  0  0  0
 14  8  2  0  0  0  0
 15  9  2  0  0  0  0
 16 15  1  0  0  0  0
 17 15  1  0  0  0  0
 18  2  1  0  0  0  0
 19  3  1  0  0  0  0
 20 11  1  0  0  0  0
 21 18  1  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
 10 17  2  0  0  0  0
  7  5  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (741)
741

>  <Formula> (741)
C18H21NO4

>  <MolWeight> (741)
315.36364

>  <PCAT_CMPD_ID> (741)
WAY-381920

>  <CNC_ID> (741)
359449575

>  <transfer_container_id> (741)
PTN000000076

>  <COMPOUND_NUMBER> (741)
WAY-381920

>  <BAR_CODE_NO> (741)
2572469

>  <LOCATION_CODE> (741)
PTNCS

>  <AMOUNT_CURRENT> (741)
32.8

$$$$
WAY-381922
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    9.7792    2.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3167    2.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4292    3.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0542    3.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9667    3.7958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  5 12  2  0  0  0  0
  6  1  2  0  0  0  0
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 10  7  1  0  0  0  0
 11 15  1  0  0  0  0
 12  1  1  0  0  0  0
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  4 11  2  0  0  0  0
M  END
>  <Mol_ID> (742)
742

>  <Formula> (742)
C14H11BrCl2N2O

>  <MolWeight> (742)
374.05994

>  <PCAT_CMPD_ID> (742)
WAY-381922

>  <CNC_ID> (742)
359449577

>  <transfer_container_id> (742)
PTN000000076

>  <COMPOUND_NUMBER> (742)
WAY-381922

>  <BAR_CODE_NO> (742)
2572471

>  <LOCATION_CODE> (742)
PTNCS

>  <AMOUNT_CURRENT> (742)
32.5

$$$$
WAY-381924
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 13  3  1  0  0  0  0
 15 16  2  0  0  0  0
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 20 21  1  0  0  0  0
 12 18  1  0  0  0  0
M  END
>  <Mol_ID> (743)
743

>  <Formula> (743)
C16H17NO3S

>  <MolWeight> (743)
303.37608

>  <PCAT_CMPD_ID> (743)
WAY-381924

>  <CNC_ID> (743)
359449579

>  <transfer_container_id> (743)
PTN000000076

>  <COMPOUND_NUMBER> (743)
WAY-381924

>  <BAR_CODE_NO> (743)
2572473

>  <LOCATION_CODE> (743)
PTNCS

>  <AMOUNT_CURRENT> (743)
32.9

$$$$
WAY-381934
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 10  1  0  0  0  0
 12  8  1  0  0  0  0
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 14  5  1  0  0  0  0
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 16  9  2  0  0  0  0
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 19  6  1  0  0  0  0
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 30 28  1  0  0  0  0
  3  5  1  0  0  0  0
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 13 15  1  0  0  0  0
 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (744)
744

>  <Formula> (744)
C23H25N3O3S

>  <MolWeight> (744)
423.5279

>  <PCAT_CMPD_ID> (744)
WAY-381934

>  <CNC_ID> (744)
359449589

>  <transfer_container_id> (744)
PTN000000076

>  <COMPOUND_NUMBER> (744)
WAY-381934

>  <BAR_CODE_NO> (744)
2572481

>  <LOCATION_CODE> (744)
PTNCS

>  <AMOUNT_CURRENT> (744)
32.3

$$$$
WAY-382015
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  4  1  0  0  0  0
 12  5  1  0  0  0  0
 13  9  2  0  0  0  0
 14  9  1  0  0  0  0
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 10 12  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <Mol_ID> (745)
745

>  <Formula> (745)
C12H14N2OS2

>  <MolWeight> (745)
266.38236

>  <PCAT_CMPD_ID> (745)
WAY-382015

>  <CNC_ID> (745)
359449671

>  <transfer_container_id> (745)
PTN000000076

>  <COMPOUND_NUMBER> (745)
WAY-382015

>  <BAR_CODE_NO> (745)
2572421

>  <LOCATION_CODE> (745)
PTNCS

>  <AMOUNT_CURRENT> (745)
32.1

$$$$
WAY-382380
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
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 26  6  2  0  0  0  0
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 17 12  2  0  0  0  0
 22 18  1  0  0  0  0
M  END
>  <Mol_ID> (746)
746

>  <Formula> (746)
C25H21NO6S

>  <MolWeight> (746)
463.50234

>  <PCAT_CMPD_ID> (746)
WAY-382380

>  <CNC_ID> (746)
359450027

>  <transfer_container_id> (746)
PTN000000076

>  <COMPOUND_NUMBER> (746)
WAY-382380

>  <BAR_CODE_NO> (746)
2572727

>  <LOCATION_CODE> (746)
PTNCS

>  <AMOUNT_CURRENT> (746)
32.3

$$$$
WAY-382088
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (747)
747

>  <Formula> (747)
C17H15N5OS

>  <MolWeight> (747)
337.3989

>  <PCAT_CMPD_ID> (747)
WAY-382088

>  <CNC_ID> (747)
359449737

>  <transfer_container_id> (747)
PTN000000076

>  <COMPOUND_NUMBER> (747)
WAY-382088

>  <BAR_CODE_NO> (747)
2572526

>  <LOCATION_CODE> (747)
PTNCS

>  <AMOUNT_CURRENT> (747)
32.3

$$$$
WAY-382151
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 14 15  1  0  0  0  0
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 17 20  1  0  0  0  0
  5  7  1  0  0  0  0
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 18 20  2  0  0  0  0
M  END
>  <Mol_ID> (748)
748

>  <Formula> (748)
C11H10N6OS2

>  <MolWeight> (748)
306.3667

>  <PCAT_CMPD_ID> (748)
WAY-382151

>  <CNC_ID> (748)
359449799

>  <transfer_container_id> (748)
PTN000000076

>  <COMPOUND_NUMBER> (748)
WAY-382151

>  <BAR_CODE_NO> (748)
2572598

>  <LOCATION_CODE> (748)
PTNCS

>  <AMOUNT_CURRENT> (748)
32.5

$$$$
WAY-382170
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
 12  7  1  0  0  0  0
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 14  7  2  0  0  0  0
 15 10  2  0  0  0  0
 16  1  1  0  0  0  0
 17  2  1  0  0  0  0
 18 10  1  0  0  0  0
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 25 19  2  0  0  0  0
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 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (749)
749

>  <Formula> (749)
C16H16BrN3O5

>  <MolWeight> (749)
410.21934

>  <PCAT_CMPD_ID> (749)
WAY-382170

>  <CNC_ID> (749)
359449818

>  <transfer_container_id> (749)
PTN000000076

>  <COMPOUND_NUMBER> (749)
WAY-382170

>  <BAR_CODE_NO> (749)
2572687

>  <LOCATION_CODE> (749)
PTNCS

>  <AMOUNT_CURRENT> (749)
32.4

$$$$
WAY-382198
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 15  3  1  0  0  0  0
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 20  5  2  0  0  0  0
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 13 10  1  0  0  0  0
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 27 28  1  0  0  0  0
 23 22  2  0  0  0  0
M  END
>  <Mol_ID> (750)
750

>  <Formula> (750)
C21H18N4O2S

>  <MolWeight> (750)
390.45822

>  <PCAT_CMPD_ID> (750)
WAY-382198

>  <CNC_ID> (750)
359449846

>  <transfer_container_id> (750)
PTN000000076

>  <COMPOUND_NUMBER> (750)
WAY-382198

>  <BAR_CODE_NO> (750)
2572844

>  <LOCATION_CODE> (750)
PTNCS

>  <AMOUNT_CURRENT> (750)
33

$$$$
WAY-382236
csChFnd80/10111816222D

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 25 17  1  0  0  0  0
 26 25  2  0  0  0  0
 27 24  1  0  0  0  0
 28 26  1  0  0  0  0
 12  4  2  0  0  0  0
 27 28  2  0  0  0  0
  9  3  2  0  0  0  0
 11  8  1  0  0  0  0
M  END
>  <Mol_ID> (751)
751

>  <Formula> (751)
C21H16N2O4S

>  <MolWeight> (751)
392.42774

>  <PCAT_CMPD_ID> (751)
WAY-382236

>  <CNC_ID> (751)
359449883

>  <transfer_container_id> (751)
PTN000000076

>  <COMPOUND_NUMBER> (751)
WAY-382236

>  <BAR_CODE_NO> (751)
2572515

>  <LOCATION_CODE> (751)
PTNCS

>  <AMOUNT_CURRENT> (751)
33

$$$$
WAY-382239
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11 20  1  0  0  0  0
 12 11  1  0  0  0  0
 13  6  2  0  0  0  0
 14  9  1  0  0  0  0
 15  5  2  0  0  0  0
 16 11  2  0  0  0  0
 17 12  1  0  0  0  0
 18 13  1  0  0  0  0
 19 16  1  0  0  0  0
 20 10  1  0  0  0  0
 21  7  2  0  0  0  0
 22  8  2  0  0  0  0
 23 21  1  0  0  0  0
 24 23  2  0  0  0  0
  2  3  2  0  0  0  0
 22 24  1  0  0  0  0
 18 14  2  0  0  0  0
 19 17  2  0  0  0  0
M  END
>  <Mol_ID> (752)
752

>  <Formula> (752)
C19H14N2O2S

>  <MolWeight> (752)
334.39166

>  <PCAT_CMPD_ID> (752)
WAY-382239

>  <CNC_ID> (752)
359449886

>  <transfer_container_id> (752)
PTN000000076

>  <COMPOUND_NUMBER> (752)
WAY-382239

>  <BAR_CODE_NO> (752)
2572586

>  <LOCATION_CODE> (752)
PTNCS

>  <AMOUNT_CURRENT> (752)
32.7

$$$$
WAY-382314
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    0.1542   -0.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
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  7  3  1  0  0  0  0
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 10 16  1  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 17 10  1  0  0  0  0
 18 11  1  0  0  0  0
 19 11  2  0  0  0  0
 20 12  1  0  0  0  0
 21 12  2  0  0  0  0
 22 19  1  0  0  0  0
 23 18  2  0  0  0  0
 24 21  1  0  0  0  0
 25 20  2  0  0  0  0
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 27 24  2  0  0  0  0
  5  6  1  0  0  0  0
 10 15  1  0  0  0  0
 26 23  1  0  0  0  0
 27 25  1  0  0  0  0
M  END
>  <Mol_ID> (753)
753

>  <Formula> (753)
C20H21N3O3S

>  <MolWeight> (753)
383.46404

>  <PCAT_CMPD_ID> (753)
WAY-382314

>  <CNC_ID> (753)
359449961

>  <transfer_container_id> (753)
PTN000000076

>  <COMPOUND_NUMBER> (753)
WAY-382314

>  <BAR_CODE_NO> (753)
2572899

>  <LOCATION_CODE> (753)
PTNCS

>  <AMOUNT_CURRENT> (753)
32.7

$$$$
WAY-382490-A
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -0.4028    0.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4028   -0.1007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0717    1.0889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 26 28  1  0  0  0  0
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 22 25  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (754)
754

>  <Formula> (754)
C21H18O7

>  <MolWeight> (754)
382.36342

>  <PCAT_CMPD_ID> (754)
WAY-382490-A

>  <CNC_ID> (754)
359450134

>  <transfer_container_id> (754)
PTN000000076

>  <COMPOUND_NUMBER> (754)
WAY-382490-A

>  <BAR_CODE_NO> (754)
2570756

>  <LOCATION_CODE> (754)
PTNCS

>  <AMOUNT_CURRENT> (754)
32.4

$$$$
WAY-311515
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  6  8  2  0  0  0  0
  7  9  1  0  0  0  0
M  END
>  <Mol_ID> (755)
755

>  <Formula> (755)
C14H19N3O2S2

>  <MolWeight> (755)
325.44956

>  <PCAT_CMPD_ID> (755)
WAY-311515

>  <CNC_ID> (755)
359315256

>  <transfer_container_id> (755)
PTN000000065

>  <COMPOUND_NUMBER> (755)
WAY-311515

>  <BAR_CODE_NO> (755)
3915908

>  <LOCATION_CODE> (755)
PTNCS

>  <AMOUNT_CURRENT> (755)
33.4

$$$$
WAY-345113
csChFnd80/10111816222D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (756)
756

>  <Formula> (756)
C8H8N2OS

>  <MolWeight> (756)
180.22692

>  <PCAT_CMPD_ID> (756)
WAY-345113

>  <CNC_ID> (756)
359320421

>  <transfer_container_id> (756)
PTN000000065

>  <COMPOUND_NUMBER> (756)
WAY-345113

>  <BAR_CODE_NO> (756)
2555415

>  <LOCATION_CODE> (756)
PTNCS

>  <AMOUNT_CURRENT> (756)
32.8

$$$$
WAY-344201
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 11  4  1  0  0  0  0
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M  END
>  <Mol_ID> (757)
757

>  <Formula> (757)
C18H14ClN5O2S

>  <MolWeight> (757)
399.85406

>  <PCAT_CMPD_ID> (757)
WAY-344201

>  <CNC_ID> (757)
359319536

>  <transfer_container_id> (757)
PTN000000065

>  <COMPOUND_NUMBER> (757)
WAY-344201

>  <BAR_CODE_NO> (757)
2554487

>  <LOCATION_CODE> (757)
PTNCS

>  <AMOUNT_CURRENT> (757)
32.4

$$$$
WAY-311550
csChFnd80/10111816222D

 12 12  0  0  0  0  0  0  0  0999 V2000
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  5 10  1  0  0  0  0
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M  END
>  <Mol_ID> (758)
758

>  <Formula> (758)
C7H8N4S

>  <MolWeight> (758)
180.23022

>  <PCAT_CMPD_ID> (758)
WAY-311550

>  <CNC_ID> (758)
359315291

>  <transfer_container_id> (758)
PTN000000065

>  <COMPOUND_NUMBER> (758)
WAY-311550

>  <BAR_CODE_NO> (758)
3915955

>  <LOCATION_CODE> (758)
PTNCS

>  <AMOUNT_CURRENT> (758)
33.1

$$$$
WAY-344254-A
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 13 14  1  0  0  0  0
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 12 13  2  0  0  0  0
M  END
>  <Mol_ID> (759)
759

>  <Formula> (759)
C11H12N2S

>  <MolWeight> (759)
204.29138

>  <PCAT_CMPD_ID> (759)
WAY-344254-A

>  <CNC_ID> (759)
359319592

>  <transfer_container_id> (759)
PTN000000065

>  <COMPOUND_NUMBER> (759)
WAY-344254-A

>  <BAR_CODE_NO> (759)
2554636

>  <LOCATION_CODE> (759)
PTNCS

>  <AMOUNT_CURRENT> (759)
32.8

$$$$
WAY-343914
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10 15  2  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
 14 12  2  0  0  0  0
 15 13  1  0  0  0  0
 16  2  1  0  0  0  0
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 18  4  1  0  0  0  0
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 20  7  1  0  0  0  0
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 14 10  1  0  0  0  0
M  END
>  <Mol_ID> (760)
760

>  <Formula> (760)
C16H22FNOS

>  <MolWeight> (760)
295.4153832

>  <PCAT_CMPD_ID> (760)
WAY-343914

>  <CNC_ID> (760)
359319254

>  <transfer_container_id> (760)
PTN000000065

>  <COMPOUND_NUMBER> (760)
WAY-343914

>  <BAR_CODE_NO> (760)
2554009

>  <LOCATION_CODE> (760)
PTNCS

>  <AMOUNT_CURRENT> (760)
32.7

$$$$
WAY-343890
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  1  0  0  0  0
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 13 11  2  0  0  0  0
 14 12  1  0  0  0  0
 15  3  2  0  0  0  0
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 17  5  2  0  0  0  0
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 19  1  1  0  0  0  0
 20 24  1  0  0  0  0
 21  8  1  0  0  0  0
 22 13  1  0  0  0  0
 23 14  1  0  0  0  0
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 16 13  1  0  0  0  0
M  END
>  <Mol_ID> (761)
761

>  <Formula> (761)
C14H12Cl2N2O5S

>  <MolWeight> (761)
391.22648

>  <PCAT_CMPD_ID> (761)
WAY-343890

>  <CNC_ID> (761)
359319231

>  <transfer_container_id> (761)
PTN000000065

>  <COMPOUND_NUMBER> (761)
WAY-343890

>  <BAR_CODE_NO> (761)
2553986

>  <LOCATION_CODE> (761)
PTNCS

>  <AMOUNT_CURRENT> (761)
32.4

$$$$
WAY-311458
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (762)
762

>  <Formula> (762)
C15H16N2O2S

>  <MolWeight> (762)
288.36474

>  <PCAT_CMPD_ID> (762)
WAY-311458

>  <CNC_ID> (762)
359315199

>  <transfer_container_id> (762)
PTN000000065

>  <COMPOUND_NUMBER> (762)
WAY-311458

>  <BAR_CODE_NO> (762)
3915847

>  <LOCATION_CODE> (762)
PTNCS

>  <AMOUNT_CURRENT> (762)
33.4

$$$$
WAY-310877
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
 11 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7  9  1  0  0  0  0
 12 14  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (763)
763

>  <Formula> (763)
C16H11FN2OS

>  <MolWeight> (763)
298.3347432

>  <PCAT_CMPD_ID> (763)
WAY-310877

>  <CNC_ID> (763)
359314619

>  <transfer_container_id> (763)
PTN000000065

>  <COMPOUND_NUMBER> (763)
WAY-310877

>  <BAR_CODE_NO> (763)
3915171

>  <LOCATION_CODE> (763)
PTNCS

>  <AMOUNT_CURRENT> (763)
33.6

$$$$
WAY-344234
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.6167   -6.4417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  1  0  0  0  0
 11  2  2  0  0  0  0
 12  4  2  0  0  0  0
 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
 15  9  2  0  0  0  0
 16 12  1  0  0  0  0
 17  8  2  0  0  0  0
 18 10  1  0  0  0  0
 19  1  1  0  0  0  0
 20 15  1  0  0  0  0
 21  3  1  0  0  0  0
 22 19  1  0  0  0  0
 23  9  1  0  0  0  0
 24 15  1  0  0  0  0
 25 20  1  0  0  0  0
 26 23  2  0  0  0  0
 27 26  1  0  0  0  0
 21 22  1  0  0  0  0
 13 16  2  0  0  0  0
 24 27  2  0  0  0  0
M  END
>  <Mol_ID> (764)
764

>  <Formula> (764)
C19H20N2O5S

>  <MolWeight> (764)
388.4375

>  <PCAT_CMPD_ID> (764)
WAY-344234

>  <CNC_ID> (764)
359319572

>  <transfer_container_id> (764)
PTN000000065

>  <COMPOUND_NUMBER> (764)
WAY-344234

>  <BAR_CODE_NO> (764)
2554583

>  <LOCATION_CODE> (764)
PTNCS

>  <AMOUNT_CURRENT> (764)
32.5

$$$$
WAY-345386
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10 14  2  0  0  0  0
 11 22  1  0  0  0  0
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 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15  6  2  0  0  0  0
 16  8  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
 19 15  1  0  0  0  0
 20 11  2  0  0  0  0
 21  1  1  0  0  0  0
 22  7  1  0  0  0  0
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 27 21  1  0  0  0  0
  3  5  1  0  0  0  0
 17 19  2  0  0  0  0
 12  8  2  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (765)
765

>  <Formula> (765)
C18H18N4O3S2

>  <MolWeight> (765)
402.49052

>  <PCAT_CMPD_ID> (765)
WAY-345386

>  <CNC_ID> (765)
359320656

>  <transfer_container_id> (765)
PTN000000065

>  <COMPOUND_NUMBER> (765)
WAY-345386

>  <BAR_CODE_NO> (765)
2555584

>  <LOCATION_CODE> (765)
PTNCS

>  <AMOUNT_CURRENT> (765)
32.6

$$$$
WAY-343592
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
 11  4  1  0  0  0  0
 12  9  1  0  0  0  0
 13  6  1  0  0  0  0
 14  9  2  0  0  0  0
 15 12  2  0  0  0  0
 16 12  1  0  0  0  0
 17 10  1  0  0  0  0
 18 11  1  0  0  0  0
 19 13  1  0  0  0  0
 20 16  1  0  0  0  0
 21 20  1  0  0  0  0
 22 19  2  0  0  0  0
 23 18  2  0  0  0  0
 10  7  1  0  0  0  0
 11 13  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (766)
766

>  <Formula> (766)
C15H15N5O3

>  <MolWeight> (766)
313.3113

>  <PCAT_CMPD_ID> (766)
WAY-343592

>  <CNC_ID> (766)
359319002

>  <transfer_container_id> (766)
PTN000000065

>  <COMPOUND_NUMBER> (766)
WAY-343592

>  <BAR_CODE_NO> (766)
2554186

>  <LOCATION_CODE> (766)
PTNCS

>  <AMOUNT_CURRENT> (766)
32.6

$$$$
WAY-344687
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 13  2  2  0  0  0  0
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 25 15  1  0  0  0  0
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  9  6  1  0  0  0  0
 20 14  1  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (767)
767

>  <Formula> (767)
C21H22N2O5

>  <MolWeight> (767)
382.40978

>  <PCAT_CMPD_ID> (767)
WAY-344687

>  <CNC_ID> (767)
359319999

>  <transfer_container_id> (767)
PTN000000065

>  <COMPOUND_NUMBER> (767)
WAY-344687

>  <BAR_CODE_NO> (767)
2554924

>  <LOCATION_CODE> (767)
PTNCS

>  <AMOUNT_CURRENT> (767)
32.7

$$$$
WAY-331807
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
   -3.3958   -0.6417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
 11  1  1  0  0  0  0
 12  9  2  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17  5  1  0  0  0  0
 18  5  1  0  0  0  0
 19  3  2  0  0  0  0
 20  8  2  0  0  0  0
 21 11  1  0  0  0  0
 22 11  2  0  0  0  0
 23  8  1  0  0  0  0
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  2 10  2  0  0  0  0
 15  6  1  0  0  0  0
M  END
>  <Mol_ID> (768)
768

>  <Formula> (768)
C20H24N2O7S

>  <MolWeight> (768)
436.47876

>  <PCAT_CMPD_ID> (768)
WAY-331807

>  <CNC_ID> (768)
359330345

>  <transfer_container_id> (768)
PTN000000067

>  <COMPOUND_NUMBER> (768)
WAY-331807

>  <BAR_CODE_NO> (768)
306808

>  <LOCATION_CODE> (768)
PTNCS

>  <AMOUNT_CURRENT> (768)
32.5

$$$$
WAY-330433
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
   -3.7958    7.0917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0  0
 11  5  1  0  0  0  0
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 13  1  2  0  0  0  0
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 17  5  2  0  0  0  0
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 31 24  1  0  0  0  0
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 33 32  1  0  0  0  0
  4 12  1  0  0  0  0
 28 23  2  0  0  0  0
  6  2  2  0  0  0  0
 30 33  1  0  0  0  0
M  END
>  <Mol_ID> (769)
769

>  <Formula> (769)
C24H27N3O5S

>  <MolWeight> (769)
469.55328

>  <PCAT_CMPD_ID> (769)
WAY-330433

>  <CNC_ID> (769)
359317788

>  <transfer_container_id> (769)
PTN000000065

>  <COMPOUND_NUMBER> (769)
WAY-330433

>  <BAR_CODE_NO> (769)
305434

>  <LOCATION_CODE> (769)
PTNCS

>  <AMOUNT_CURRENT> (769)
32.5

$$$$
WAY-329611
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
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 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16  9  1  0  0  0  0
 17  9  2  0  0  0  0
 18  8  1  0  0  0  0
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 14 15  2  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (770)
770

>  <Formula> (770)
C20H20O5

>  <MolWeight> (770)
340.3698

>  <PCAT_CMPD_ID> (770)
WAY-329611

>  <CNC_ID> (770)
359316979

>  <transfer_container_id> (770)
PTN000000065

>  <COMPOUND_NUMBER> (770)
WAY-329611

>  <BAR_CODE_NO> (770)
304612

>  <LOCATION_CODE> (770)
PTNCS

>  <AMOUNT_CURRENT> (770)
32.5

$$$$
WAY-642675
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
 11  1  2  0  0  0  0
 12  5  2  0  0  0  0
 13  2  2  0  0  0  0
 14  9  1  0  0  0  0
 15 20  1  0  0  0  0
 16 18  2  0  0  0  0
 17 12  1  0  0  0  0
 18 10  1  0  0  0  0
 19  7  1  0  0  0  0
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 22 10  1  0  0  0  0
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 24 23  2  0  0  0  0
 14 17  2  0  0  0  0
  6 16  1  0  0  0  0
 21 15  2  0  0  0  0
M  END
>  <Mol_ID> (771)
771

>  <Formula> (771)
C18H15N3O3

>  <MolWeight> (771)
321.33

>  <PCAT_CMPD_ID> (771)
WAY-642675

>  <CNC_ID> (771)
359324413

>  <transfer_container_id> (771)
PTN000000065

>  <COMPOUND_NUMBER> (771)
WAY-642675

>  <BAR_CODE_NO> (771)
90477237

>  <LOCATION_CODE> (771)
PTNCS

>  <AMOUNT_CURRENT> (771)
32.2

$$$$
WAY-623981
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (772)
772

>  <Formula> (772)
C25H23N5O3S

>  <MolWeight> (772)
473.54682

>  <PCAT_CMPD_ID> (772)
WAY-623981

>  <CNC_ID> (772)
359322601

>  <transfer_container_id> (772)
PTN000000065

>  <COMPOUND_NUMBER> (772)
WAY-623981

>  <BAR_CODE_NO> (772)
90458155

>  <LOCATION_CODE> (772)
PTNCS

>  <AMOUNT_CURRENT> (772)
32.9

$$$$
WAY-641687
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 11  2  1  0  0  0  0
 12  1  1  0  0  0  0
 13  6  1  0  0  0  0
 14  7  1  0  0  0  0
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  4  3  1  0  0  0  0
 17 14  2  0  0  0  0
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 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (773)
773

>  <Formula> (773)
C15H10FN5OS

>  <MolWeight> (773)
327.3362032

>  <PCAT_CMPD_ID> (773)
WAY-641687

>  <CNC_ID> (773)
359323425

>  <transfer_container_id> (773)
PTN000000065

>  <COMPOUND_NUMBER> (773)
WAY-641687

>  <BAR_CODE_NO> (773)
90476239

>  <LOCATION_CODE> (773)
PTNCS

>  <AMOUNT_CURRENT> (773)
32.6

$$$$
WAY-331912
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
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 12  6  2  0  0  0  0
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M  END
>  <Mol_ID> (774)
774

>  <Formula> (774)
C26H30FN3O2

>  <MolWeight> (774)
435.5337032

>  <PCAT_CMPD_ID> (774)
WAY-331912

>  <CNC_ID> (774)
359330450

>  <transfer_container_id> (774)
PTN000000067

>  <COMPOUND_NUMBER> (774)
WAY-331912

>  <BAR_CODE_NO> (774)
306913

>  <LOCATION_CODE> (774)
PTNCS

>  <AMOUNT_CURRENT> (774)
32.5

$$$$
WAY-331928
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (775)
775

>  <Formula> (775)
C25H28ClN3O3

>  <MolWeight> (775)
453.96112

>  <PCAT_CMPD_ID> (775)
WAY-331928

>  <CNC_ID> (775)
359330466

>  <transfer_container_id> (775)
PTN000000067

>  <COMPOUND_NUMBER> (775)
WAY-331928

>  <BAR_CODE_NO> (775)
306929

>  <LOCATION_CODE> (775)
PTNCS

>  <AMOUNT_CURRENT> (775)
32.5

$$$$
WAY-330606
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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 11  1  1  0  0  0  0
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 23  7  1  0  0  0  0
 24  9  1  0  0  0  0
 25  8  1  0  0  0  0
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 27  5  2  0  0  0  0
 28  4  2  0  0  0  0
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 30 24  1  0  0  0  0
 31 25  1  0  0  0  0
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 33 32  2  0  0  0  0
 14 16  1  0  0  0  0
  8  7  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (776)
776

>  <Formula> (776)
C25H24N2O6

>  <MolWeight> (776)
448.46786

>  <PCAT_CMPD_ID> (776)
WAY-330606

>  <CNC_ID> (776)
359317961

>  <transfer_container_id> (776)
PTN000000065

>  <COMPOUND_NUMBER> (776)
WAY-330606

>  <BAR_CODE_NO> (776)
305607

>  <LOCATION_CODE> (776)
PTNCS

>  <AMOUNT_CURRENT> (776)
32.5

$$$$
WAY-643481
csChFnd80/10111816222D

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  3  9  1  0  0  0  0
  4  2  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  5  1  0  0  0  0
 12  7  1  0  0  0  0
 13  1  1  0  0  0  0
 14 13  1  0  0  0  0
 15  2  2  0  0  0  0
 16 18  1  0  0  0  0
 17  9  2  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20  4  1  0  0  0  0
 21  7  1  0  0  0  0
 22  8  1  0  0  0  0
 23 10  1  0  0  0  0
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 25 20  2  0  0  0  0
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 28 24  2  0  0  0  0
 11  4  2  0  0  0  0
 25 28  1  0  0  0  0
 10 12  1  0  0  0  0
 27 23  2  0  0  0  0
M  END
>  <Mol_ID> (777)
777

>  <Formula> (777)
C21H19N3O4

>  <MolWeight> (777)
377.39326

>  <PCAT_CMPD_ID> (777)
WAY-643481

>  <CNC_ID> (777)
359325219

>  <transfer_container_id> (777)
PTN000000065

>  <COMPOUND_NUMBER> (777)
WAY-643481

>  <BAR_CODE_NO> (777)
90478053

>  <LOCATION_CODE> (777)
PTNCS

>  <AMOUNT_CURRENT> (777)
32.7

$$$$
WAY-333952
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  4  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14 16  2  0  0  0  0
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 18  5  1  0  0  0  0
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  6  5  1  0  0  0  0
M  END
>  <Mol_ID> (778)
778

>  <Formula> (778)
C11H11BrN2O2S2

>  <MolWeight> (778)
347.25124

>  <PCAT_CMPD_ID> (778)
WAY-333952

>  <CNC_ID> (778)
359332485

>  <transfer_container_id> (778)
PTN000000067

>  <COMPOUND_NUMBER> (778)
WAY-333952

>  <BAR_CODE_NO> (778)
308953

>  <LOCATION_CODE> (778)
PTNCS

>  <AMOUNT_CURRENT> (778)
32.5

$$$$
WAY-333953
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  6  5  1  0  0  0  0
M  END
>  <Mol_ID> (779)
779

>  <Formula> (779)
C11H11ClN2O2S2

>  <MolWeight> (779)
302.80024

>  <PCAT_CMPD_ID> (779)
WAY-333953

>  <CNC_ID> (779)
359332486

>  <transfer_container_id> (779)
PTN000000067

>  <COMPOUND_NUMBER> (779)
WAY-333953

>  <BAR_CODE_NO> (779)
308954

>  <LOCATION_CODE> (779)
PTNCS

>  <AMOUNT_CURRENT> (779)
32.5

$$$$
WAY-333957
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  4  1  0  0  0  0
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 17  5  1  0  0  0  0
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  6  5  1  0  0  0  0
M  END
>  <Mol_ID> (780)
780

>  <Formula> (780)
C12H14N2O2S2

>  <MolWeight> (780)
282.38176

>  <PCAT_CMPD_ID> (780)
WAY-333957

>  <CNC_ID> (780)
359332490

>  <transfer_container_id> (780)
PTN000000067

>  <COMPOUND_NUMBER> (780)
WAY-333957

>  <BAR_CODE_NO> (780)
308958

>  <LOCATION_CODE> (780)
PTNCS

>  <AMOUNT_CURRENT> (780)
32.5

$$$$
WAY-333956
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3 11  1  0  0  0  0
  4  1  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  4  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14 16  2  0  0  0  0
 15 12  2  0  0  0  0
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 18  5  1  0  0  0  0
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 15 14  1  0  0  0  0
  6  5  1  0  0  0  0
M  END
>  <Mol_ID> (781)
781

>  <Formula> (781)
C12H14N2O3S2

>  <MolWeight> (781)
298.38116

>  <PCAT_CMPD_ID> (781)
WAY-333956

>  <CNC_ID> (781)
359332489

>  <transfer_container_id> (781)
PTN000000067

>  <COMPOUND_NUMBER> (781)
WAY-333956

>  <BAR_CODE_NO> (781)
308957

>  <LOCATION_CODE> (781)
PTNCS

>  <AMOUNT_CURRENT> (781)
32.5

$$$$
WAY-333962
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   -0.7125    3.0208    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  5  1  1  0  0  0  0
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  8  2  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  2  2  0  0  0  0
 13  5  1  0  0  0  0
 14 12  1  0  0  0  0
 15  8  2  0  0  0  0
 16 14  2  0  0  0  0
 17 12  1  0  0  0  0
 18 15  1  0  0  0  0
 19  6  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 16 15  1  0  0  0  0
  7  6  1  0  0  0  0
M  END
>  <Mol_ID> (782)
782

>  <Formula> (782)
C13H16N2O4S2

>  <MolWeight> (782)
328.40714

>  <PCAT_CMPD_ID> (782)
WAY-333962

>  <CNC_ID> (782)
359332495

>  <transfer_container_id> (782)
PTN000000067

>  <COMPOUND_NUMBER> (782)
WAY-333962

>  <BAR_CODE_NO> (782)
308963

>  <LOCATION_CODE> (782)
PTNCS

>  <AMOUNT_CURRENT> (782)
32.5

$$$$
WAY-331855
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
  -13.2500   -2.4542    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2750    1.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  2  1  0  0  0  0
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  8 10  1  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11 12  1  0  0  0  0
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 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  3  2  0  0  0  0
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 17 19  1  0  0  0  0
 18  6  1  0  0  0  0
 19  6  1  0  0  0  0
 20  4  2  0  0  0  0
 21  9  2  0  0  0  0
 22  9  1  0  0  0  0
 23  3  1  0  0  0  0
 24 15  1  0  0  0  0
 25 15  1  0  0  0  0
 26 22  1  0  0  0  0
 27 24  1  0  0  0  0
 28 23  2  0  0  0  0
 29 26  1  0  0  0  0
 30 28  1  0  0  0  0
  2 11  2  0  0  0  0
 25 30  2  0  0  0  0
 16  7  1  0  0  0  0
M  END
>  <Mol_ID> (783)
783

>  <Formula> (783)
C20H24N2O7S

>  <MolWeight> (783)
436.47876

>  <PCAT_CMPD_ID> (783)
WAY-331855

>  <CNC_ID> (783)
359330393

>  <transfer_container_id> (783)
PTN000000067

>  <COMPOUND_NUMBER> (783)
WAY-331855

>  <BAR_CODE_NO> (783)
306856

>  <LOCATION_CODE> (783)
PTNCS

>  <AMOUNT_CURRENT> (783)
32.5

$$$$
WAY-331869
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  1  2  0  0  0  0
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 13  2  2  0  0  0  0
 14  5  2  0  0  0  0
 15  9  1  0  0  0  0
 16  2  1  0  0  0  0
 17 13  1  0  0  0  0
 18 13  1  0  0  0  0
 19 17  1  0  0  0  0
 20 15  1  0  0  0  0
 21 15  1  0  0  0  0
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 25 21  1  0  0  0  0
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 18 23  2  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (784)
784

>  <Formula> (784)
C19H23NO5S

>  <MolWeight> (784)
377.45462

>  <PCAT_CMPD_ID> (784)
WAY-331869

>  <CNC_ID> (784)
359330407

>  <transfer_container_id> (784)
PTN000000067

>  <COMPOUND_NUMBER> (784)
WAY-331869

>  <BAR_CODE_NO> (784)
306870

>  <LOCATION_CODE> (784)
PTNCS

>  <AMOUNT_CURRENT> (784)
32.5

$$$$
WAY-333979
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  6  1  0  0  0  0
 13 17  2  0  0  0  0
 14  9  1  0  0  0  0
 15  9  2  0  0  0  0
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 17  7  1  0  0  0  0
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 21  7  2  0  0  0  0
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 23 21  1  0  0  0  0
 18 16  1  0  0  0  0
  4  2  1  0  0  0  0
 22 13  1  0  0  0  0
M  END
>  <Mol_ID> (785)
785

>  <Formula> (785)
C15H12BrN3O2S2

>  <MolWeight> (785)
410.30868

>  <PCAT_CMPD_ID> (785)
WAY-333979

>  <CNC_ID> (785)
359332512

>  <transfer_container_id> (785)
PTN000000067

>  <COMPOUND_NUMBER> (785)
WAY-333979

>  <BAR_CODE_NO> (785)
308980

>  <LOCATION_CODE> (785)
PTNCS

>  <AMOUNT_CURRENT> (785)
32.5

$$$$
WAY-624485
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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  6  1  1  0  0  0  0
  7 10  1  0  0  0  0
  8  1  1  0  0  0  0
  9  8  2  0  0  0  0
 10 12  1  0  0  0  0
 11  7  1  0  0  0  0
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 13 11  1  0  0  0  0
 14 13  2  0  0  0  0
 15  2  1  0  0  0  0
 16 14  1  0  0  0  0
 17  8  1  0  0  0  0
 18  9  1  0  0  0  0
 19 20  2  0  0  0  0
 20 13  1  0  0  0  0
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 24 18  2  0  0  0  0
  7  5  2  0  0  0  0
 21 16  2  0  0  0  0
M  END
>  <Mol_ID> (786)
786

>  <Formula> (786)
C19H18N4S

>  <MolWeight> (786)
334.43802

>  <PCAT_CMPD_ID> (786)
WAY-624485

>  <CNC_ID> (786)
359322906

>  <transfer_container_id> (786)
PTN000000065

>  <COMPOUND_NUMBER> (786)
WAY-624485

>  <BAR_CODE_NO> (786)
90458661

>  <LOCATION_CODE> (786)
PTNCS

>  <AMOUNT_CURRENT> (786)
32.7

$$$$
WAY-643782
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  2  0  0  0  0
  5 10  1  0  0  0  0
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  7 15  1  0  0  0  0
  8  6  1  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 13 16  2  0  0  0  0
 14  4  1  0  0  0  0
 15 18  2  0  0  0  0
 16 17  1  0  0  0  0
 17  9  1  0  0  0  0
 18 16  1  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
 21 20  2  0  0  0  0
 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
  5  3  1  0  0  0  0
 23 22  2  0  0  0  0
  7  6  2  0  0  0  0
 12 11  1  0  0  0  0
M  END
>  <Mol_ID> (787)
787

>  <Formula> (787)
C17H15N3O2S

>  <MolWeight> (787)
325.3849

>  <PCAT_CMPD_ID> (787)
WAY-643782

>  <CNC_ID> (787)
359325520

>  <transfer_container_id> (787)
PTN000000065

>  <COMPOUND_NUMBER> (787)
WAY-643782

>  <BAR_CODE_NO> (787)
90478354

>  <LOCATION_CODE> (787)
PTNCS

>  <AMOUNT_CURRENT> (787)
32.9

$$$$
WAY-333318
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   -3.7708    4.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  9  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  2  0  0  0  0
  8  5  1  0  0  0  0
  9 16  1  0  0  0  0
 10  2  2  0  0  0  0
 11  2  2  0  0  0  0
 12  2  1  0  0  0  0
 13  5  2  0  0  0  0
 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16 20  2  0  0  0  0
 17 19  1  0  0  0  0
 18  3  1  0  0  0  0
 19 21  2  0  0  0  0
 20 21  1  0  0  0  0
 21 25  1  0  0  0  0
 22 15  1  0  0  0  0
 23  6  1  0  0  0  0
 24  7  1  0  0  0  0
 25 22  1  0  0  0  0
 26 23  2  0  0  0  0
 27 26  1  0  0  0  0
  4  7  1  0  0  0  0
 24 27  2  0  0  0  0
  9 17  2  0  0  0  0
M  END
>  <Mol_ID> (788)
788

>  <Formula> (788)
C19H19N3O4S

>  <MolWeight> (788)
385.43686

>  <PCAT_CMPD_ID> (788)
WAY-333318

>  <CNC_ID> (788)
359331852

>  <transfer_container_id> (788)
PTN000000067

>  <COMPOUND_NUMBER> (788)
WAY-333318

>  <BAR_CODE_NO> (788)
308319

>  <LOCATION_CODE> (788)
PTNCS

>  <AMOUNT_CURRENT> (788)
32.5

$$$$
WAY-624486
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4 11  1  0  0  0  0
  5 13  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  2  0  0  0  0
  8  3  1  0  0  0  0
  9  2  1  0  0  0  0
 10  2  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  8  1  0  0  0  0
 14  4  1  0  0  0  0
 15  3  2  0  0  0  0
 16  7  1  0  0  0  0
 17  5  2  0  0  0  0
 18  6  1  0  0  0  0
 19 16  1  0  0  0  0
 20 14  1  0  0  0  0
 21 14  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
 19 18  1  0  0  0  0
  4 12  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (789)
789

>  <Formula> (789)
C17H20N2O5

>  <MolWeight> (789)
332.3511

>  <PCAT_CMPD_ID> (789)
WAY-624486

>  <CNC_ID> (789)
359322907

>  <transfer_container_id> (789)
PTN000000065

>  <COMPOUND_NUMBER> (789)
WAY-624486

>  <BAR_CODE_NO> (789)
90458662

>  <LOCATION_CODE> (789)
PTNCS

>  <AMOUNT_CURRENT> (789)
32.3

$$$$
WAY-332716
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  9  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  2  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  2  0  0  0  0
 14 10  1  0  0  0  0
 15 13  1  0  0  0  0
 16  6  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 21 17  2  0  0  0  0
 22 19  1  0  0  0  0
 23 16  1  0  0  0  0
 24 16  1  0  0  0  0
  8  5  1  0  0  0  0
 19 21  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (790)
790

>  <Formula> (790)
C17H16ClN3O2S

>  <MolWeight> (790)
361.84584

>  <PCAT_CMPD_ID> (790)
WAY-332716

>  <CNC_ID> (790)
359331252

>  <transfer_container_id> (790)
PTN000000067

>  <COMPOUND_NUMBER> (790)
WAY-332716

>  <BAR_CODE_NO> (790)
307717

>  <LOCATION_CODE> (790)
PTNCS

>  <AMOUNT_CURRENT> (790)
32.5

$$$$
WAY-641820
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
   -1.1500   -2.9750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6625   -2.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  2  0  0  0  0
  6 17  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  2  0  0  0  0
 10  3  1  0  0  0  0
 11  7  2  0  0  0  0
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 13 14  1  0  0  0  0
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 18  8  1  0  0  0  0
 19 18  1  0  0  0  0
  5  4  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (791)
791

>  <Formula> (791)
C12H12FN3OS2

>  <MolWeight> (791)
297.3715832

>  <PCAT_CMPD_ID> (791)
WAY-641820

>  <CNC_ID> (791)
359323558

>  <transfer_container_id> (791)
PTN000000065

>  <COMPOUND_NUMBER> (791)
WAY-641820

>  <BAR_CODE_NO> (791)
90476373

>  <LOCATION_CODE> (791)
PTNCS

>  <AMOUNT_CURRENT> (791)
32.5

$$$$
WAY-333175
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  2  0  0  0  0
  9  7  1  0  0  0  0
 10  4  1  0  0  0  0
 11  3  1  0  0  0  0
 12  5  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15 11  2  0  0  0  0
 16 15  1  0  0  0  0
 17 13  2  0  0  0  0
 18 14  1  0  0  0  0
 19 18  2  0  0  0  0
  9  6  1  0  0  0  0
 16 12  2  0  0  0  0
 17 19  1  0  0  0  0
M  END
>  <Mol_ID> (792)
792

>  <Formula> (792)
C16H15NOS

>  <MolWeight> (792)
269.3614

>  <PCAT_CMPD_ID> (792)
WAY-333175

>  <CNC_ID> (792)
359331710

>  <transfer_container_id> (792)
PTN000000067

>  <COMPOUND_NUMBER> (792)
WAY-333175

>  <BAR_CODE_NO> (792)
308176

>  <LOCATION_CODE> (792)
PTNCS

>  <AMOUNT_CURRENT> (792)
32.5

$$$$
WAY-333885
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  8  2  0  0  0  0
 12 11  1  0  0  0  0
 13 16  1  0  0  0  0
 14  5  2  0  0  0  0
 15  8  1  0  0  0  0
 16 15  2  0  0  0  0
 17  2  1  0  0  0  0
 18 12  1  0  0  0  0
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 20  6  1  0  0  0  0
 21 18  1  0  0  0  0
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 23 17  2  0  0  0  0
 24 23  1  0  0  0  0
 25  4  1  0  0  0  0
  4  5  1  0  0  0  0
 24 20  2  0  0  0  0
 12 13  2  0  0  0  0
M  END
>  <Mol_ID> (793)
793

>  <Formula> (793)
C17H17NO5S

>  <MolWeight> (793)
347.38558

>  <PCAT_CMPD_ID> (793)
WAY-333885

>  <CNC_ID> (793)
359332418

>  <transfer_container_id> (793)
PTN000000067

>  <COMPOUND_NUMBER> (793)
WAY-333885

>  <BAR_CODE_NO> (793)
308886

>  <LOCATION_CODE> (793)
PTNCS

>  <AMOUNT_CURRENT> (793)
32.5

$$$$
WAY-624832
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    0.6792    0.1958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8708   -0.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  1  0  0  0  0
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 10  9  2  0  0  0  0
 11 15  1  0  0  0  0
 12  5  1  0  0  0  0
 13  1  1  0  0  0  0
 14  3  1  0  0  0  0
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 21  7  1  0  0  0  0
 22  6  1  0  0  0  0
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 29 20  1  0  0  0  0
 30 29  1  0  0  0  0
  4  8  1  0  0  0  0
 28 30  1  0  0  0  0
 23 24  2  0  0  0  0
  7 10  1  0  0  0  0
M  END
>  <Mol_ID> (794)
794

>  <Formula> (794)
C22H25ClN4O2S

>  <MolWeight> (794)
444.9775

>  <PCAT_CMPD_ID> (794)
WAY-624832

>  <CNC_ID> (794)
359323253

>  <transfer_container_id> (794)
PTN000000065

>  <COMPOUND_NUMBER> (794)
WAY-624832

>  <BAR_CODE_NO> (794)
90459010

>  <LOCATION_CODE> (794)
PTNCS

>  <AMOUNT_CURRENT> (794)
32.6

$$$$
WAY-332227
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  1  0  0  0  0
 14  3  1  0  0  0  0
 15 11  2  0  0  0  0
 16  6  2  0  0  0  0
 17  5  2  0  0  0  0
 18 15  1  0  0  0  0
 19 21  1  0  0  0  0
 20 25  1  0  0  0  0
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 26 27  2  0  0  0  0
 27 17  1  0  0  0  0
  6  4  1  0  0  0  0
 16 26  1  0  0  0  0
 15 22  1  0  0  0  0
M  END
>  <Mol_ID> (795)
795

>  <Formula> (795)
C21H22N2O4

>  <MolWeight> (795)
366.41038

>  <PCAT_CMPD_ID> (795)
WAY-332227

>  <CNC_ID> (795)
359330763

>  <transfer_container_id> (795)
PTN000000067

>  <COMPOUND_NUMBER> (795)
WAY-332227

>  <BAR_CODE_NO> (795)
307228

>  <LOCATION_CODE> (795)
PTNCS

>  <AMOUNT_CURRENT> (795)
32.5

$$$$
WAY-616700
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
 13  5  1  0  0  0  0
 14 18  2  0  0  0  0
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 17 13  2  0  0  0  0
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 19 14  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (796)
796

>  <Formula> (796)
C20H19NO6

>  <MolWeight> (796)
369.36796

>  <PCAT_CMPD_ID> (796)
WAY-616700

>  <CNC_ID> (796)
359321786

>  <transfer_container_id> (796)
PTN000000065

>  <COMPOUND_NUMBER> (796)
WAY-616700

>  <BAR_CODE_NO> (796)
90450694

>  <LOCATION_CODE> (796)
PTNCS

>  <AMOUNT_CURRENT> (796)
32.7

$$$$
WAY-624647
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
 11 15  1  0  0  0  0
 12  4  1  0  0  0  0
 13  2  1  0  0  0  0
 14  1  1  0  0  0  0
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 16 11  2  0  0  0  0
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 19  5  1  0  0  0  0
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 25 24  1  0  0  0  0
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 27 22  1  0  0  0  0
 28 26  1  0  0  0  0
  7  6  1  0  0  0  0
 28 27  2  0  0  0  0
  2 10  1  0  0  0  0
 21 25  1  0  0  0  0
M  END
>  <Mol_ID> (797)
797

>  <Formula> (797)
C20H23N5O2S

>  <MolWeight> (797)
397.49392

>  <PCAT_CMPD_ID> (797)
WAY-624647

>  <CNC_ID> (797)
359323068

>  <transfer_container_id> (797)
PTN000000065

>  <COMPOUND_NUMBER> (797)
WAY-624647

>  <BAR_CODE_NO> (797)
90458823

>  <LOCATION_CODE> (797)
PTNCS

>  <AMOUNT_CURRENT> (797)
32.4

$$$$
WAY-330548
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11  5  1  0  0  0  0
 12  3  2  0  0  0  0
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 17 16  2  0  0  0  0
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 19  9  2  0  0  0  0
 20  9  1  0  0  0  0
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 25  8  1  0  0  0  0
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 13 18  2  0  0  0  0
 24 22  2  0  0  0  0
M  END
>  <Mol_ID> (798)
798

>  <Formula> (798)
C21H19N3O3

>  <MolWeight> (798)
361.39386

>  <PCAT_CMPD_ID> (798)
WAY-330548

>  <CNC_ID> (798)
359317903

>  <transfer_container_id> (798)
PTN000000065

>  <COMPOUND_NUMBER> (798)
WAY-330548

>  <BAR_CODE_NO> (798)
305549

>  <LOCATION_CODE> (798)
PTNCS

>  <AMOUNT_CURRENT> (798)
32.5

$$$$
WAY-624969
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10 21  1  0  0  0  0
 11  1  1  0  0  0  0
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 14  5  1  0  0  0  0
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 16  2  2  0  0  0  0
 17  3  2  0  0  0  0
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 10  9  2  0  0  0  0
  6  8  1  0  0  0  0
M  END
>  <Mol_ID> (799)
799

>  <Formula> (799)
C20H19N5O4

>  <MolWeight> (799)
393.39596

>  <PCAT_CMPD_ID> (799)
WAY-624969

>  <CNC_ID> (799)
359323390

>  <transfer_container_id> (799)
PTN000000065

>  <COMPOUND_NUMBER> (799)
WAY-624969

>  <BAR_CODE_NO> (799)
90459149

>  <LOCATION_CODE> (799)
PTNCS

>  <AMOUNT_CURRENT> (799)
32.2

$$$$
WAY-330072
csChFnd80/10111816222D

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 10  3  2  0  0  0  0
 11  7  1  0  0  0  0
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 13  7  2  0  0  0  0
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 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
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 18 14  2  0  0  0  0
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 20 15  2  0  0  0  0
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 16 21  2  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (800)
800

>  <Formula> (800)
C17H15N3O4

>  <MolWeight> (800)
325.3187

>  <PCAT_CMPD_ID> (800)
WAY-330072

>  <CNC_ID> (800)
359317437

>  <transfer_container_id> (800)
PTN000000065

>  <COMPOUND_NUMBER> (800)
WAY-330072

>  <BAR_CODE_NO> (800)
305073

>  <LOCATION_CODE> (800)
PTNCS

>  <AMOUNT_CURRENT> (800)
32.5

$$$$
WAY-643404
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  4  3  1  0  0  0  0
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 10  1  1  0  0  0  0
 11 10  2  0  0  0  0
 12  1  1  0  0  0  0
 13 14  1  0  0  0  0
 14 12  1  0  0  0  0
 15  9  2  0  0  0  0
 16  6  2  0  0  0  0
 17  7  2  0  0  0  0
 18 12  2  0  0  0  0
 19  5  1  0  0  0  0
 20  9  1  0  0  0  0
 21 10  1  0  0  0  0
 22 11  1  0  0  0  0
 23 15  1  0  0  0  0
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 27 22  2  0  0  0  0
 15  8  1  0  0  0  0
 29 23  2  0  0  0  0
M  END
>  <Mol_ID> (801)
801

>  <Formula> (801)
C20H17N5O4

>  <MolWeight> (801)
391.38008

>  <PCAT_CMPD_ID> (801)
WAY-643404

>  <CNC_ID> (801)
359325142

>  <transfer_container_id> (801)
PTN000000065

>  <COMPOUND_NUMBER> (801)
WAY-643404

>  <BAR_CODE_NO> (801)
90477976

>  <LOCATION_CODE> (801)
PTNCS

>  <AMOUNT_CURRENT> (801)
32.8

$$$$
WAY-644005
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10 15  2  0  0  0  0
 12 16  2  0  0  0  0
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 17 20  1  0  0  0  0
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 11 15  1  0  0  0  0
 14 16  1  0  0  0  0
M  END
>  <Mol_ID> (802)
802

>  <Formula> (802)
C12H6ClF3N4

>  <MolWeight> (802)
298.6510496

>  <PCAT_CMPD_ID> (802)
WAY-644005

>  <CNC_ID> (802)
359325744

>  <transfer_container_id> (802)
PTN000000065

>  <COMPOUND_NUMBER> (802)
WAY-644005

>  <BAR_CODE_NO> (802)
90478580

>  <LOCATION_CODE> (802)
PTNCS

>  <AMOUNT_CURRENT> (802)
32.2

$$$$
WAY-616490
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10 17  1  0  0  0  0
 11  1  1  0  0  0  0
 12  6  1  0  0  0  0
 13  3  1  0  0  0  0
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 15  2  1  0  0  0  0
 16  2  2  0  0  0  0
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 29  5  1  0  0  0  0
 30  8  1  0  0  0  0
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 24 17  2  0  0  0  0
 13 27  2  0  0  0  0
M  END
>  <Mol_ID> (803)
803

>  <Formula> (803)
C20H17ClN4O5

>  <MolWeight> (803)
428.82578

>  <PCAT_CMPD_ID> (803)
WAY-616490

>  <CNC_ID> (803)
359321576

>  <transfer_container_id> (803)
PTN000000065

>  <COMPOUND_NUMBER> (803)
WAY-616490

>  <BAR_CODE_NO> (803)
90450482

>  <LOCATION_CODE> (803)
PTNCS

>  <AMOUNT_CURRENT> (803)
32.9

$$$$
WAY-333784
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
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 17 19  1  0  0  0  0
 13 22  1  0  0  0  0
M  END
>  <Mol_ID> (804)
804

>  <Formula> (804)
C17H12ClN5O

>  <MolWeight> (804)
337.76308

>  <PCAT_CMPD_ID> (804)
WAY-333784

>  <CNC_ID> (804)
359332317

>  <transfer_container_id> (804)
PTN000000067

>  <COMPOUND_NUMBER> (804)
WAY-333784

>  <BAR_CODE_NO> (804)
308785

>  <LOCATION_CODE> (804)
PTNCS

>  <AMOUNT_CURRENT> (804)
32.5

$$$$
WAY-332438
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 14  3  1  0  0  0  0
 15  3  1  0  0  0  0
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 20  5  2  0  0  0  0
 21  9  1  0  0  0  0
 22  8  2  0  0  0  0
 23  8  1  0  0  0  0
 24  7  2  0  0  0  0
 25  7  1  0  0  0  0
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 18  6  1  0  0  0  0
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 27 31  2  0  0  0  0
M  END
>  <Mol_ID> (805)
805

>  <Formula> (805)
C24H29N3O5S

>  <MolWeight> (805)
471.56916

>  <PCAT_CMPD_ID> (805)
WAY-332438

>  <CNC_ID> (805)
359330974

>  <transfer_container_id> (805)
PTN000000067

>  <COMPOUND_NUMBER> (805)
WAY-332438

>  <BAR_CODE_NO> (805)
307439

>  <LOCATION_CODE> (805)
PTNCS

>  <AMOUNT_CURRENT> (805)
32.5

$$$$
WAY-624673
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  6  9  1  0  0  0  0
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  8  4  2  0  0  0  0
  9  1  1  0  0  0  0
 10  2  1  0  0  0  0
 11  2  2  0  0  0  0
 12 13  1  0  0  0  0
 13  5  1  0  0  0  0
 14  6  2  0  0  0  0
 15  5  2  0  0  0  0
 16  7  2  0  0  0  0
 17 11  1  0  0  0  0
 18  4  1  0  0  0  0
 19  8  1  0  0  0  0
 20 10  1  0  0  0  0
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 22 18  2  0  0  0  0
 23 22  1  0  0  0  0
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 23 19  2  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (806)
806

>  <Formula> (806)
C15H14N2O6

>  <MolWeight> (806)
318.28146

>  <PCAT_CMPD_ID> (806)
WAY-624673

>  <CNC_ID> (806)
359323094

>  <transfer_container_id> (806)
PTN000000065

>  <COMPOUND_NUMBER> (806)
WAY-624673

>  <BAR_CODE_NO> (806)
90458849

>  <LOCATION_CODE> (806)
PTNCS

>  <AMOUNT_CURRENT> (806)
32.3

$$$$
WAY-333865
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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 13 15  1  0  0  0  0
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 15  6  1  0  0  0  0
 16  3  1  0  0  0  0
 17  5  2  0  0  0  0
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 21 27  1  0  0  0  0
M  END
>  <Mol_ID> (807)
807

>  <Formula> (807)
C20H23N5O4

>  <MolWeight> (807)
397.42772

>  <PCAT_CMPD_ID> (807)
WAY-333865

>  <CNC_ID> (807)
359332398

>  <transfer_container_id> (807)
PTN000000067

>  <COMPOUND_NUMBER> (807)
WAY-333865

>  <BAR_CODE_NO> (807)
308866

>  <LOCATION_CODE> (807)
PTNCS

>  <AMOUNT_CURRENT> (807)
32.5

$$$$
WAY-331336
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  2  2  0  0  0  0
 12  1  2  0  0  0  0
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 17 10  2  0  0  0  0
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 26  4  1  0  0  0  0
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 22 19  1  0  0  0  0
M  END
>  <Mol_ID> (808)
808

>  <Formula> (808)
C16H15ClN4O3S2

>  <MolWeight> (808)
410.8983

>  <PCAT_CMPD_ID> (808)
WAY-331336

>  <CNC_ID> (808)
359318691

>  <transfer_container_id> (808)
PTN000000065

>  <COMPOUND_NUMBER> (808)
WAY-331336

>  <BAR_CODE_NO> (808)
306337

>  <LOCATION_CODE> (808)
PTNCS

>  <AMOUNT_CURRENT> (808)
32.5

$$$$
WAY-330206
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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   15.9875    5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6875    7.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
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  8 16  1  0  0  0  0
  9  8  1  0  0  0  0
 10  6  2  0  0  0  0
 11 25  1  0  0  0  0
 12 11  1  0  0  0  0
 13  2  2  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16 28  1  0  0  0  0
 17 13  1  0  0  0  0
 18 17  2  0  0  0  0
 19  4  1  0  0  0  0
 20  4  1  0  0  0  0
 21 12  2  0  0  0  0
 22  9  1  0  0  0  0
 23  9  1  0  0  0  0
 24 22  1  0  0  0  0
 25 23  1  0  0  0  0
 26 12  1  0  0  0  0
 27  8  2  0  0  0  0
 28 20  1  0  0  0  0
 29 19  1  0  0  0  0
 30 21  1  0  0  0  0
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 33 21  1  0  0  0  0
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 29 16  1  0  0  0  0
 18  6  1  0  0  0  0
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 24 11  1  0  0  0  0
 32 30  2  0  0  0  0
M  END
>  <Mol_ID> (809)
809

>  <Formula> (809)
C24H29N5O3S2

>  <MolWeight> (809)
499.64876

>  <PCAT_CMPD_ID> (809)
WAY-330206

>  <CNC_ID> (809)
359317571

>  <transfer_container_id> (809)
PTN000000065

>  <COMPOUND_NUMBER> (809)
WAY-330206

>  <BAR_CODE_NO> (809)
305207

>  <LOCATION_CODE> (809)
PTNCS

>  <AMOUNT_CURRENT> (809)
32.5

$$$$
WAY-333876
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
  -12.3542    6.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  2  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  0  0  0  0
 11  6  1  0  0  0  0
 12  5  2  0  0  0  0
 13 11  1  0  0  0  0
 14 13  2  0  0  0  0
 15 14  1  0  0  0  0
 16 20  2  0  0  0  0
 17 10  1  0  0  0  0
 18 10  1  0  0  0  0
 19 10  1  0  0  0  0
 20 13  1  0  0  0  0
 21 16  1  0  0  0  0
 22 15  1  0  0  0  0
  7  9  2  0  0  0  0
  6  5  1  0  0  0  0
 15 21  2  0  0  0  0
M  END
>  <Mol_ID> (810)
810

>  <Formula> (810)
C17H20N4O

>  <MolWeight> (810)
296.3669

>  <PCAT_CMPD_ID> (810)
WAY-333876

>  <CNC_ID> (810)
359332409

>  <transfer_container_id> (810)
PTN000000067

>  <COMPOUND_NUMBER> (810)
WAY-333876

>  <BAR_CODE_NO> (810)
308877

>  <LOCATION_CODE> (810)
PTNCS

>  <AMOUNT_CURRENT> (810)
32.5

$$$$
WAY-616942
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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  5  9  2  0  0  0  0
  6  8  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  2  0  0  0  0
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 10  2  1  0  0  0  0
 11  1  1  0  0  0  0
 12 16  1  0  0  0  0
 13  3  1  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16  7  1  0  0  0  0
 17 10  1  0  0  0  0
 18  7  2  0  0  0  0
 19 11  1  0  0  0  0
 20 11  2  0  0  0  0
 21 22  2  0  0  0  0
 22 20  1  0  0  0  0
 23 19  2  0  0  0  0
 24 21  1  0  0  0  0
 25 17  1  0  0  0  0
 26  8  1  0  0  0  0
 27  9  1  0  0  0  0
 23 21  1  0  0  0  0
 13 17  1  0  0  0  0
  5  6  1  0  0  0  0
M  END
>  <Mol_ID> (811)
811

>  <Formula> (811)
C17H19ClN2O6S

>  <MolWeight> (811)
414.86056

>  <PCAT_CMPD_ID> (811)
WAY-616942

>  <CNC_ID> (811)
359322028

>  <transfer_container_id> (811)
PTN000000065

>  <COMPOUND_NUMBER> (811)
WAY-616942

>  <BAR_CODE_NO> (811)
90450942

>  <LOCATION_CODE> (811)
PTNCS

>  <AMOUNT_CURRENT> (811)
32.1

$$$$
WAY-616032
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  5  1  0  0  0  0
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 10  6  1  0  0  0  0
 11  2  2  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  7  1  0  0  0  0
 15 13  2  0  0  0  0
 16 15  1  0  0  0  0
  7  4  1  0  0  0  0
  9 10  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (812)
812

>  <Formula> (812)
C12H12N2O2

>  <MolWeight> (812)
216.23588

>  <PCAT_CMPD_ID> (812)
WAY-616032

>  <CNC_ID> (812)
359321117

>  <transfer_container_id> (812)
PTN000000065

>  <COMPOUND_NUMBER> (812)
WAY-616032

>  <BAR_CODE_NO> (812)
90450009

>  <LOCATION_CODE> (812)
PTNCS

>  <AMOUNT_CURRENT> (812)
32.6

$$$$
WAY-329515
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    4.8397    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  5  2  0  0  0  0
 12  6  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15 12  1  0  0  0  0
 16  7  2  0  0  0  0
 17 21  1  0  0  0  0
 18 11  1  0  0  0  0
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 20  3  1  0  0  0  0
 21 20  1  0  0  0  0
 22 18  1  0  0  0  0
  4  3  2  0  0  0  0
 19 16  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (813)
813

>  <Formula> (813)
C17H16N2O2S

>  <MolWeight> (813)
312.38614

>  <PCAT_CMPD_ID> (813)
WAY-329515

>  <CNC_ID> (813)
359316883

>  <transfer_container_id> (813)
PTN000000065

>  <COMPOUND_NUMBER> (813)
WAY-329515

>  <BAR_CODE_NO> (813)
304516

>  <LOCATION_CODE> (813)
PTNCS

>  <AMOUNT_CURRENT> (813)
32.5

$$$$
WAY-616451
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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    1.1875    0.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2417    0.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1000    0.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3333   -2.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0458   -1.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1000    2.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8125    1.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8125    2.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6 17  1  0  0  0  0
  7  1  1  0  0  0  0
  8 20  1  0  0  0  0
  9 19  1  0  0  0  0
 10  6  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  3  1  0  0  0  0
 14  9  1  0  0  0  0
 15  3  2  0  0  0  0
 16  8  1  0  0  0  0
 17 21  1  0  0  0  0
 18  4  1  0  0  0  0
 19 18  2  0  0  0  0
 20 17  1  0  0  0  0
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 22 10  1  0  0  0  0
 23  7  1  0  0  0  0
 24  7  1  0  0  0  0
 25 16  1  0  0  0  0
 26 22  2  0  0  0  0
 27 25  2  0  0  0  0
  2  9  2  0  0  0  0
 10 16  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (814)
814

>  <Formula> (814)
C17H19N3O6S

>  <MolWeight> (814)
393.41426

>  <PCAT_CMPD_ID> (814)
WAY-616451

>  <CNC_ID> (814)
359321536

>  <transfer_container_id> (814)
PTN000000065

>  <COMPOUND_NUMBER> (814)
WAY-616451

>  <BAR_CODE_NO> (814)
90450438

>  <LOCATION_CODE> (814)
PTNCS

>  <AMOUNT_CURRENT> (814)
32.2

$$$$
WAY-333234
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -6.9792    7.3917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7000    7.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.9792    4.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8458    3.6500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7000    4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1250    8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5208    8.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1250    3.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6167    7.3542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7917   16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  7  2  0  0  0  0
 11 10  1  0  0  0  0
 12  8  1  0  0  0  0
 13  3  2  0  0  0  0
 14  8  2  0  0  0  0
 15 12  1  0  0  0  0
 16 15  1  0  0  0  0
 17 11  1  0  0  0  0
 18 16  1  0  0  0  0
 19 16  2  0  0  0  0
 20 18  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  2  0  0  0  0
 11  9  2  0  0  0  0
  2  6  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (815)
815

>  <Formula> (815)
C17H15N3O2

>  <MolWeight> (815)
293.3199

>  <PCAT_CMPD_ID> (815)
WAY-333234

>  <CNC_ID> (815)
359331769

>  <transfer_container_id> (815)
PTN000000067

>  <COMPOUND_NUMBER> (815)
WAY-333234

>  <BAR_CODE_NO> (815)
308235

>  <LOCATION_CODE> (815)
PTNCS

>  <AMOUNT_CURRENT> (815)
32.5

$$$$
WAY-333224
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    9.0042  -14.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8625  -13.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.6917  -15.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1667  -13.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3167  -14.0042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3500  -10.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5000   -9.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  6  1  0  0  0  0
  5  4  2  0  0  0  0
  6  1  2  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  3  1  0  0  0  0
 10  2  2  0  0  0  0
 11 13  1  0  0  0  0
 12  5  1  0  0  0  0
 13  8  1  0  0  0  0
 14  7  2  0  0  0  0
 15  9  2  0  0  0  0
 16 11  2  0  0  0  0
 17 12  2  0  0  0  0
 18 16  1  0  0  0  0
 19 11  1  0  0  0  0
 20 16  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  2  0  0  0  0
 23 22  1  0  0  0  0
  5  3  1  0  0  0  0
 17 15  1  0  0  0  0
 20 23  2  0  0  0  0
M  END
>  <Mol_ID> (816)
816

>  <Formula> (816)
C17H15N3O3

>  <MolWeight> (816)
309.3193

>  <PCAT_CMPD_ID> (816)
WAY-333224

>  <CNC_ID> (816)
359331759

>  <transfer_container_id> (816)
PTN000000067

>  <COMPOUND_NUMBER> (816)
WAY-333224

>  <BAR_CODE_NO> (816)
308225

>  <LOCATION_CODE> (816)
PTNCS

>  <AMOUNT_CURRENT> (816)
32.5

$$$$
WAY-333237
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -5.6875    6.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1958    5.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9458    7.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6875    3.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9458    2.9708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1958    3.9708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4167    7.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4208    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4167    2.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1500    6.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1500    3.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  7  2  0  0  0  0
 11 10  1  0  0  0  0
 12  8  1  0  0  0  0
 13  3  2  0  0  0  0
 14  8  2  0  0  0  0
 15 12  1  0  0  0  0
 16 15  1  0  0  0  0
 17 21  2  0  0  0  0
 18 16  1  0  0  0  0
 19 16  2  0  0  0  0
 20 18  2  0  0  0  0
 21 19  1  0  0  0  0
 22 17  1  0  0  0  0
 23 11  1  0  0  0  0
 24 22  1  0  0  0  0
  9 11  2  0  0  0  0
  6  2  2  0  0  0  0
 20 17  1  0  0  0  0
M  END
>  <Mol_ID> (817)
817

>  <Formula> (817)
C18H17N3O3

>  <MolWeight> (817)
323.34588

>  <PCAT_CMPD_ID> (817)
WAY-333237

>  <CNC_ID> (817)
359331772

>  <transfer_container_id> (817)
PTN000000067

>  <COMPOUND_NUMBER> (817)
WAY-333237

>  <BAR_CODE_NO> (817)
308238

>  <LOCATION_CODE> (817)
PTNCS

>  <AMOUNT_CURRENT> (817)
32.5

$$$$
WAY-616404
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
    2.4500   -1.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9375   -0.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9375   -2.0750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7375    2.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3250    1.4500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3250    2.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8625   -2.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5 17  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
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 10 19  1  0  0  0  0
 11  1  1  0  0  0  0
 12  8  1  0  0  0  0
 13 28  1  0  0  0  0
 14  4  2  0  0  0  0
 15  6  1  0  0  0  0
 16  8  2  0  0  0  0
 17 27  1  0  0  0  0
 18 26  1  0  0  0  0
 19  9  1  0  0  0  0
 20 12  1  0  0  0  0
 21  9  2  0  0  0  0
 22 16  1  0  0  0  0
 23  7  1  0  0  0  0
 24 11  1  0  0  0  0
 25 11  2  0  0  0  0
 26 10  1  0  0  0  0
 27 10  1  0  0  0  0
 28 30  2  0  0  0  0
 29 15  2  0  0  0  0
 30 25  1  0  0  0  0
 31 24  2  0  0  0  0
 32 23  2  0  0  0  0
 33 29  1  0  0  0  0
  7  6  2  0  0  0  0
 31 28  1  0  0  0  0
 29 32  1  0  0  0  0
 18  5  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (818)
818

>  <Formula> (818)
C25H24N4O3S

>  <MolWeight> (818)
460.54806

>  <PCAT_CMPD_ID> (818)
WAY-616404

>  <CNC_ID> (818)
359321489

>  <transfer_container_id> (818)
PTN000000065

>  <COMPOUND_NUMBER> (818)
WAY-616404

>  <BAR_CODE_NO> (818)
90450391

>  <LOCATION_CODE> (818)
PTNCS

>  <AMOUNT_CURRENT> (818)
32

$$$$
WAY-278377
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
   -2.2500    1.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9958    1.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7 10  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10  3  2  0  0  0  0
 11  5  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 14 11  2  0  0  0  0
 15 16  2  0  0  0  0
 16  9  1  0  0  0  0
 17 13  1  0  0  0  0
 18 13  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 21 17  2  0  0  0  0
 22 12  1  0  0  0  0
 23 19  1  0  0  0  0
 24 23  1  0  0  0  0
  9  2  2  0  0  0  0
 15 10  1  0  0  0  0
 12  7  2  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (819)
819

>  <Formula> (819)
C17H13N3O2S2

>  <MolWeight> (819)
355.43402

>  <PCAT_CMPD_ID> (819)
WAY-278377

>  <CNC_ID> (819)
359327097

>  <transfer_container_id> (819)
PTN000000067

>  <COMPOUND_NUMBER> (819)
WAY-278377

>  <BAR_CODE_NO> (819)
389032

>  <LOCATION_CODE> (819)
PTNCS

>  <AMOUNT_CURRENT> (819)
32.5

$$$$
WAY-329096
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    6.1000   -7.1167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9292   -7.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1667   -2.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1875   -4.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  2  0  0  0  0
 12  2  2  0  0  0  0
 13  7  2  0  0  0  0
 14 24  2  0  0  0  0
 15  8  2  0  0  0  0
 16 21  2  0  0  0  0
 17 18  1  0  0  0  0
 18 10  1  0  0  0  0
 19  9  1  0  0  0  0
 20  4  1  0  0  0  0
 21 15  1  0  0  0  0
 22 16  1  0  0  0  0
 23  5  1  0  0  0  0
 24 17  1  0  0  0  0
 25 28  2  0  0  0  0
 26 17  2  0  0  0  0
 27 20  2  0  0  0  0
 28 26  1  0  0  0  0
 29 23  2  0  0  0  0
  4  5  2  0  0  0  0
 29 27  1  0  0  0  0
 16 11  1  0  0  0  0
 25 14  1  0  0  0  0
M  END
>  <Mol_ID> (820)
820

>  <Formula> (820)
C22H17ClFN3O2

>  <MolWeight> (820)
409.8406832

>  <PCAT_CMPD_ID> (820)
WAY-329096

>  <CNC_ID> (820)
359316461

>  <transfer_container_id> (820)
PTN000000065

>  <COMPOUND_NUMBER> (820)
WAY-329096

>  <BAR_CODE_NO> (820)
304097

>  <LOCATION_CODE> (820)
PTNCS

>  <AMOUNT_CURRENT> (820)
32.5

$$$$
WAY-278421
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -0.4898   -0.2853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  7  3  0  0  0  0
  9  5  1  0  0  0  0
  9 10  2  0  0  0  0
 11  9  1  0  0  0  0
 12 13  1  0  0  0  0
 13 11  2  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16  6  1  0  0  0  0
 17  6  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
  5  4  2  0  0  0  0
 19 20  1  0  0  0  0
 14 12  2  0  0  0  0
M  END
>  <Mol_ID> (821)
821

>  <Formula> (821)
C15H14ClN3O

>  <MolWeight> (821)
287.74416

>  <PCAT_CMPD_ID> (821)
WAY-278421

>  <CNC_ID> (821)
359327141

>  <transfer_container_id> (821)
PTN000000067

>  <COMPOUND_NUMBER> (821)
WAY-278421

>  <BAR_CODE_NO> (821)
389076

>  <LOCATION_CODE> (821)
PTNCS

>  <AMOUNT_CURRENT> (821)
32.5

$$$$
WAY-624958
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    2.2917    0.7208    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4667    0.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2458   -1.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6  3  1  0  0  0  0
  7  8  1  0  0  0  0
  8 17  1  0  0  0  0
  9  4  1  0  0  0  0
 10  6  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  2  2  0  0  0  0
 14  2  1  0  0  0  0
 15 14  2  0  0  0  0
 16  8  2  0  0  0  0
 17 15  1  0  0  0  0
 18 24  1  0  0  0  0
 19 13  1  0  0  0  0
 20  5  1  0  0  0  0
 21  5  1  0  0  0  0
 22 15  1  0  0  0  0
 23 13  1  0  0  0  0
 24 21  1  0  0  0  0
 25 20  1  0  0  0  0
 26  9  1  0  0  0  0
 27 10  1  0  0  0  0
 28 23  1  0  0  0  0
 29 26  2  0  0  0  0
 30 27  2  0  0  0  0
 18 25  1  0  0  0  0
 22 19  2  0  0  0  0
 10  9  2  0  0  0  0
 30 29  1  0  0  0  0
M  END
>  <Mol_ID> (822)
822

>  <Formula> (822)
C20H21N3O5S2

>  <MolWeight> (822)
447.52784

>  <PCAT_CMPD_ID> (822)
WAY-624958

>  <CNC_ID> (822)
359323379

>  <transfer_container_id> (822)
PTN000000065

>  <COMPOUND_NUMBER> (822)
WAY-624958

>  <BAR_CODE_NO> (822)
90459138

>  <LOCATION_CODE> (822)
PTNCS

>  <AMOUNT_CURRENT> (822)
32.8

$$$$
WAY-331458
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
   -8.3000   11.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13  5  1  0  0  0  0
 14 11  1  0  0  0  0
 15 13  1  0  0  0  0
 16 13  2  0  0  0  0
 17 12  2  0  0  0  0
 18 20  2  0  0  0  0
 19 14  2  0  0  0  0
 20 16  1  0  0  0  0
 21 15  2  0  0  0  0
 22 18  1  0  0  0  0
 23 17  1  0  0  0  0
 24 23  1  0  0  0  0
 10 11  2  0  0  0  0
  5  6  2  0  0  0  0
 17 19  1  0  0  0  0
 18 21  1  0  0  0  0
M  END
>  <Mol_ID> (823)
823

>  <Formula> (823)
C16H11ClN4O2S

>  <MolWeight> (823)
358.80214

>  <PCAT_CMPD_ID> (823)
WAY-331458

>  <CNC_ID> (823)
359318810

>  <transfer_container_id> (823)
PTN000000065

>  <COMPOUND_NUMBER> (823)
WAY-331458

>  <BAR_CODE_NO> (823)
306459

>  <LOCATION_CODE> (823)
PTNCS

>  <AMOUNT_CURRENT> (823)
32.5

$$$$
WAY-331455
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -8.3000   11.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
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  5  7  1  0  0  0  0
  6  1  2  0  0  0  0
  7  4  2  0  0  0  0
  8  1  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  1  0  0  0  0
 11  9  1  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16 13  2  0  0  0  0
 17 15  2  0  0  0  0
 18 10  2  0  0  0  0
 19 14  1  0  0  0  0
 20 16  1  0  0  0  0
 21 14  2  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
 24 18  1  0  0  0  0
 25 24  2  0  0  0  0
 11 12  2  0  0  0  0
  2  5  2  0  0  0  0
 16 17  1  0  0  0  0
 25 21  1  0  0  0  0
M  END
>  <Mol_ID> (824)
824

>  <Formula> (824)
C17H14N4O3S

>  <MolWeight> (824)
354.38306

>  <PCAT_CMPD_ID> (824)
WAY-331455

>  <CNC_ID> (824)
359318807

>  <transfer_container_id> (824)
PTN000000065

>  <COMPOUND_NUMBER> (824)
WAY-331455

>  <BAR_CODE_NO> (824)
306456

>  <LOCATION_CODE> (824)
PTNCS

>  <AMOUNT_CURRENT> (824)
32.5

$$$$
WAY-329090
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.4667   -6.5375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4000   -7.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11  2  2  0  0  0  0
 12  8  2  0  0  0  0
 13  7  2  0  0  0  0
 14  8  1  0  0  0  0
 15 18  2  0  0  0  0
 16  9  1  0  0  0  0
 17  4  1  0  0  0  0
 18 13  1  0  0  0  0
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 20  5  1  0  0  0  0
 21 14  1  0  0  0  0
 22 23  1  0  0  0  0
 23 21  1  0  0  0  0
 24 22  2  0  0  0  0
 25 22  1  0  0  0  0
 26 17  2  0  0  0  0
 27 20  2  0  0  0  0
 28 25  2  0  0  0  0
 29 24  1  0  0  0  0
 30 28  1  0  0  0  0
  4  5  2  0  0  0  0
 27 26  1  0  0  0  0
 15 10  1  0  0  0  0
 30 29  2  0  0  0  0
M  END
>  <Mol_ID> (825)
825

>  <Formula> (825)
C24H20ClFN2O2

>  <MolWeight> (825)
422.8792032

>  <PCAT_CMPD_ID> (825)
WAY-329090

>  <CNC_ID> (825)
359316455

>  <transfer_container_id> (825)
PTN000000065

>  <COMPOUND_NUMBER> (825)
WAY-329090

>  <BAR_CODE_NO> (825)
304091

>  <LOCATION_CODE> (825)
PTNCS

>  <AMOUNT_CURRENT> (825)
32.5

$$$$
WAY-331463
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -8.3000   11.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  6  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  4  1  0  0  0  0
 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  1  0  0  0  0
 13  8  1  0  0  0  0
 14 11  2  0  0  0  0
 15 12  1  0  0  0  0
 16 13  2  0  0  0  0
 17 11  1  0  0  0  0
 18 15  2  0  0  0  0
 19 16  1  0  0  0  0
 20 17  1  0  0  0  0
 21 20  1  0  0  0  0
  8 12  2  0  0  0  0
  2 10  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (826)
826

>  <Formula> (826)
C13H10FN3O2S2

>  <MolWeight> (826)
323.3658032

>  <PCAT_CMPD_ID> (826)
WAY-331463

>  <CNC_ID> (826)
359318815

>  <transfer_container_id> (826)
PTN000000065

>  <COMPOUND_NUMBER> (826)
WAY-331463

>  <BAR_CODE_NO> (826)
306464

>  <LOCATION_CODE> (826)
PTNCS

>  <AMOUNT_CURRENT> (826)
32.5

$$$$
WAY-278833
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11 14  1  0  0  0  0
 12  7  2  0  0  0  0
 13  8  2  0  0  0  0
 14  4  1  0  0  0  0
 15 10  1  0  0  0  0
 16 13  1  0  0  0  0
 17  6  1  0  0  0  0
 18  9  1  0  0  0  0
 19  9  2  0  0  0  0
 20 22  2  0  0  0  0
 21 18  2  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
 24 23  1  0  0  0  0
  6  3  2  0  0  0  0
 17 11  1  0  0  0  0
 21 20  1  0  0  0  0
 16 15  2  0  0  0  0
M  END
>  <Mol_ID> (827)
827

>  <Formula> (827)
C17H15N3O2S2

>  <MolWeight> (827)
357.4499

>  <PCAT_CMPD_ID> (827)
WAY-278833

>  <CNC_ID> (827)
359327552

>  <transfer_container_id> (827)
PTN000000067

>  <COMPOUND_NUMBER> (827)
WAY-278833

>  <BAR_CODE_NO> (827)
389488

>  <LOCATION_CODE> (827)
PTNCS

>  <AMOUNT_CURRENT> (827)
32.5

$$$$
WAY-624511
csChFnd80/10111816222D

 32 37  0  0  0  0  0  0  0  0999 V2000
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 25  9  1  0  0  0  0
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M  END
>  <Mol_ID> (828)
828

>  <Formula> (828)
C26H22N4O2

>  <MolWeight> (828)
422.47848

>  <PCAT_CMPD_ID> (828)
WAY-624511

>  <CNC_ID> (828)
359322932

>  <transfer_container_id> (828)
PTN000000065

>  <COMPOUND_NUMBER> (828)
WAY-624511

>  <BAR_CODE_NO> (828)
90458687

>  <LOCATION_CODE> (828)
PTNCS

>  <AMOUNT_CURRENT> (828)
32.3

$$$$
WAY-331469
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13 12  2  0  0  0  0
 14  7  2  0  0  0  0
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 17  9  1  0  0  0  0
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 14 13  1  0  0  0  0
M  END
>  <Mol_ID> (829)
829

>  <Formula> (829)
C12H14N2O2S

>  <MolWeight> (829)
250.31676

>  <PCAT_CMPD_ID> (829)
WAY-331469

>  <CNC_ID> (829)
359318820

>  <transfer_container_id> (829)
PTN000000065

>  <COMPOUND_NUMBER> (829)
WAY-331469

>  <BAR_CODE_NO> (829)
306470

>  <LOCATION_CODE> (829)
PTNCS

>  <AMOUNT_CURRENT> (829)
32.5

$$$$
WAY-616381
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 13  5  1  0  0  0  0
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 15  8  1  0  0  0  0
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 18  7  2  0  0  0  0
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 22 20  1  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <Mol_ID> (830)
830

>  <Formula> (830)
C16H21N3O3S

>  <MolWeight> (830)
335.42124

>  <PCAT_CMPD_ID> (830)
WAY-616381

>  <CNC_ID> (830)
359321466

>  <transfer_container_id> (830)
PTN000000065

>  <COMPOUND_NUMBER> (830)
WAY-616381

>  <BAR_CODE_NO> (830)
90450368

>  <LOCATION_CODE> (830)
PTNCS

>  <AMOUNT_CURRENT> (830)
32.6

$$$$
WAY-641916
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
 11  5  1  0  0  0  0
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 13  8  2  0  0  0  0
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 19 15  1  0  0  0  0
 27 23  2  0  0  0  0
M  END
>  <Mol_ID> (831)
831

>  <Formula> (831)
C23H18ClN3O

>  <MolWeight> (831)
387.86152

>  <PCAT_CMPD_ID> (831)
WAY-641916

>  <CNC_ID> (831)
359323654

>  <transfer_container_id> (831)
PTN000000065

>  <COMPOUND_NUMBER> (831)
WAY-641916

>  <BAR_CODE_NO> (831)
90476469

>  <LOCATION_CODE> (831)
PTNCS

>  <AMOUNT_CURRENT> (831)
32.6

$$$$
WAY-643804
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  3  2  0  0  0  0
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 15  5  2  0  0  0  0
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 18  5  1  0  0  0  0
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M  END
>  <Mol_ID> (832)
832

>  <Formula> (832)
C18H22N2O4S2

>  <MolWeight> (832)
394.50828

>  <PCAT_CMPD_ID> (832)
WAY-643804

>  <CNC_ID> (832)
359325542

>  <transfer_container_id> (832)
PTN000000065

>  <COMPOUND_NUMBER> (832)
WAY-643804

>  <BAR_CODE_NO> (832)
90478376

>  <LOCATION_CODE> (832)
PTNCS

>  <AMOUNT_CURRENT> (832)
32.1

$$$$
WAY-329648
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 22 23  1  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (833)
833

>  <Formula> (833)
C20H20BrN3O3

>  <MolWeight> (833)
430.2951

>  <PCAT_CMPD_ID> (833)
WAY-329648

>  <CNC_ID> (833)
359317016

>  <transfer_container_id> (833)
PTN000000065

>  <COMPOUND_NUMBER> (833)
WAY-329648

>  <BAR_CODE_NO> (833)
304649

>  <LOCATION_CODE> (833)
PTNCS

>  <AMOUNT_CURRENT> (833)
32.5

$$$$
WAY-624761
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 11 10  2  0  0  0  0
 12  2  2  0  0  0  0
 13  3  2  0  0  0  0
 14  1  1  0  0  0  0
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M  END
>  <Mol_ID> (834)
834

>  <Formula> (834)
C20H18FN3O3

>  <MolWeight> (834)
367.3736232

>  <PCAT_CMPD_ID> (834)
WAY-624761

>  <CNC_ID> (834)
359323182

>  <transfer_container_id> (834)
PTN000000065

>  <COMPOUND_NUMBER> (834)
WAY-624761

>  <BAR_CODE_NO> (834)
90458938

>  <LOCATION_CODE> (834)
PTNCS

>  <AMOUNT_CURRENT> (834)
32.5

$$$$
WAY-623988
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  5  1  0  0  0  0
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 14  2  2  0  0  0  0
 15  5  2  0  0  0  0
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 17  8  1  0  0  0  0
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 23  1  1  0  0  0  0
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 10  9  1  0  0  0  0
M  END
>  <Mol_ID> (835)
835

>  <Formula> (835)
C22H22FNO5

>  <MolWeight> (835)
399.4121832

>  <PCAT_CMPD_ID> (835)
WAY-623988

>  <CNC_ID> (835)
359322608

>  <transfer_container_id> (835)
PTN000000065

>  <COMPOUND_NUMBER> (835)
WAY-623988

>  <BAR_CODE_NO> (835)
90458162

>  <LOCATION_CODE> (835)
PTNCS

>  <AMOUNT_CURRENT> (835)
32.6

$$$$
WAY-643018
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (836)
836

>  <Formula> (836)
C18H16N4O

>  <MolWeight> (836)
304.34584

>  <PCAT_CMPD_ID> (836)
WAY-643018

>  <CNC_ID> (836)
359324756

>  <transfer_container_id> (836)
PTN000000065

>  <COMPOUND_NUMBER> (836)
WAY-643018

>  <BAR_CODE_NO> (836)
90477586

>  <LOCATION_CODE> (836)
PTNCS

>  <AMOUNT_CURRENT> (836)
33

$$$$
WAY-278451
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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 15 17  1  0  0  0  0
 22 26  1  0  0  0  0
M  END
>  <Mol_ID> (837)
837

>  <Formula> (837)
C19H16N2O4S

>  <MolWeight> (837)
368.40634

>  <PCAT_CMPD_ID> (837)
WAY-278451

>  <CNC_ID> (837)
359327171

>  <transfer_container_id> (837)
PTN000000067

>  <COMPOUND_NUMBER> (837)
WAY-278451

>  <BAR_CODE_NO> (837)
389106

>  <LOCATION_CODE> (837)
PTNCS

>  <AMOUNT_CURRENT> (837)
20.2

$$$$
WAY-643157
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
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   -1.5458   -2.3292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  1  0  0  0  0
 13  3  2  0  0  0  0
 14  3  2  0  0  0  0
 15 20  1  0  0  0  0
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 17  5  2  0  0  0  0
 18  4  2  0  0  0  0
 19  9  2  0  0  0  0
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 22  2  1  0  0  0  0
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 31  9  1  0  0  0  0
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 35 34  1  0  0  0  0
  2  6  1  0  0  0  0
 15  7  1  0  0  0  0
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 35 32  2  0  0  0  0
 30 29  2  0  0  0  0
M  END
>  <Mol_ID> (838)
838

>  <Formula> (838)
C24H26N4O6S

>  <MolWeight> (838)
498.55144

>  <PCAT_CMPD_ID> (838)
WAY-643157

>  <CNC_ID> (838)
359324895

>  <transfer_container_id> (838)
PTN000000065

>  <COMPOUND_NUMBER> (838)
WAY-643157

>  <BAR_CODE_NO> (838)
90477727

>  <LOCATION_CODE> (838)
PTNCS

>  <AMOUNT_CURRENT> (838)
32.7

$$$$
WAY-623687
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
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 14  3  1  0  0  0  0
 15  8  1  0  0  0  0
 16  9  2  0  0  0  0
 17  7  1  0  0  0  0
 18  8  2  0  0  0  0
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 25  9  1  0  0  0  0
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 27 20  1  0  0  0  0
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 12  6  1  0  0  0  0
 20 24  2  0  0  0  0
M  END
>  <Mol_ID> (839)
839

>  <Formula> (839)
C20H19NO6

>  <MolWeight> (839)
369.36796

>  <PCAT_CMPD_ID> (839)
WAY-623687

>  <CNC_ID> (839)
359322307

>  <transfer_container_id> (839)
PTN000000065

>  <COMPOUND_NUMBER> (839)
WAY-623687

>  <BAR_CODE_NO> (839)
90457856

>  <LOCATION_CODE> (839)
PTNCS

>  <AMOUNT_CURRENT> (839)
32.6

$$$$
WAY-332711
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  2  2  0  0  0  0
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 14  3  2  0  0  0  0
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 16  6  2  0  0  0  0
 17  9  2  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20  7  1  0  0  0  0
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  3  4  1  0  0  0  0
 19 23  1  0  0  0  0
 17 14  1  0  0  0  0
 21 25  2  0  0  0  0
M  END
>  <Mol_ID> (840)
840

>  <Formula> (840)
C21H16ClN3O

>  <MolWeight> (840)
361.82424

>  <PCAT_CMPD_ID> (840)
WAY-332711

>  <CNC_ID> (840)
359331247

>  <transfer_container_id> (840)
PTN000000067

>  <COMPOUND_NUMBER> (840)
WAY-332711

>  <BAR_CODE_NO> (840)
307712

>  <LOCATION_CODE> (840)
PTNCS

>  <AMOUNT_CURRENT> (840)
32.5

$$$$
WAY-663387
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
    0.4792    1.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  3  1  0  0  0  0
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  7  2  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  6  2  0  0  0  0
 12  8  1  0  0  0  0
 13  7  1  0  0  0  0
 14  6  1  0  0  0  0
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 13  9  1  0  0  0  0
M  END
>  <Mol_ID> (841)
841

>  <Formula> (841)
C10H15NO3

>  <MolWeight> (841)
197.231

>  <PCAT_CMPD_ID> (841)
WAY-663387

>  <CNC_ID> (841)
359326290

>  <transfer_container_id> (841)
PTN000000065

>  <COMPOUND_NUMBER> (841)
WAY-663387

>  <BAR_CODE_NO> (841)
90498134

>  <LOCATION_CODE> (841)
PTNCS

>  <AMOUNT_CURRENT> (841)
32.3

$$$$
WAY-329011
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   -0.9083  -10.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0292  -12.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9083  -12.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4625   -0.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  4  1  0  0  0  0
  9  3  2  0  0  0  0
 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
 12  5  1  0  0  0  0
 13  2  1  0  0  0  0
 14 17  2  0  0  0  0
 15 11  1  0  0  0  0
 16 11  2  0  0  0  0
 17 16  1  0  0  0  0
 18 15  2  0  0  0  0
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 20 12  1  0  0  0  0
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 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
  8  6  1  0  0  0  0
 14 18  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (842)
842

>  <Formula> (842)
C20H28N2O2

>  <MolWeight> (842)
328.44852

>  <PCAT_CMPD_ID> (842)
WAY-329011

>  <CNC_ID> (842)
359316376

>  <transfer_container_id> (842)
PTN000000065

>  <COMPOUND_NUMBER> (842)
WAY-329011

>  <BAR_CODE_NO> (842)
304012

>  <LOCATION_CODE> (842)
PTNCS

>  <AMOUNT_CURRENT> (842)
32.5

$$$$
WAY-329007
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   10.0417   -7.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3000   -5.3500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.5417   -3.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2292   -8.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0042   -8.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0042  -11.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0417   -1.4792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6167   -4.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8000   -6.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2792   -4.5250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917  -12.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7375  -11.0042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2750    0.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6250   -3.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0667  -12.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7750    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12  4  2  0  0  0  0
 13 11  1  0  0  0  0
 14  7  1  0  0  0  0
 15  2  1  0  0  0  0
 16  6  2  0  0  0  0
 17 11  2  0  0  0  0
 18 14  1  0  0  0  0
 19 14  1  0  0  0  0
 20 16  1  0  0  0  0
 21 20  2  0  0  0  0
 22 18  1  0  0  0  0
 23 19  1  0  0  0  0
  8  9  1  0  0  0  0
 21 17  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (843)
843

>  <Formula> (843)
C18H23ClN2O2

>  <MolWeight> (843)
334.84042

>  <PCAT_CMPD_ID> (843)
WAY-329007

>  <CNC_ID> (843)
359316372

>  <transfer_container_id> (843)
PTN000000065

>  <COMPOUND_NUMBER> (843)
WAY-329007

>  <BAR_CODE_NO> (843)
304008

>  <LOCATION_CODE> (843)
PTNCS

>  <AMOUNT_CURRENT> (843)
32.5

$$$$
WAY-334004
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -3.3208    3.3833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0500    3.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5 10  1  0  0  0  0
  6  4  2  0  0  0  0
  7  2  1  0  0  0  0
  8  5  2  0  0  0  0
  9  5  1  0  0  0  0
 10 12  1  0  0  0  0
 11  4  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  2  0  0  0  0
 15  9  1  0  0  0  0
 16  9  2  0  0  0  0
 17 15  2  0  0  0  0
 18 13  2  0  0  0  0
 19 14  1  0  0  0  0
 20 16  1  0  0  0  0
 21 19  2  0  0  0  0
 22 20  2  0  0  0  0
  6  3  1  0  0  0  0
 21 18  1  0  0  0  0
 17 22  1  0  0  0  0
M  END
>  <Mol_ID> (844)
844

>  <Formula> (844)
C18H16N2OS

>  <MolWeight> (844)
308.39744

>  <PCAT_CMPD_ID> (844)
WAY-334004

>  <CNC_ID> (844)
359332537

>  <transfer_container_id> (844)
PTN000000067

>  <COMPOUND_NUMBER> (844)
WAY-334004

>  <BAR_CODE_NO> (844)
309005

>  <LOCATION_CODE> (844)
PTNCS

>  <AMOUNT_CURRENT> (844)
32.5

$$$$
WAY-334003
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -3.3208    3.3833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0500    3.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3333    0.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5 11  1  0  0  0  0
  6  4  2  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  2  0  0  0  0
 10  5  2  0  0  0  0
 11 14  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16  7  1  0  0  0  0
 17 16  2  0  0  0  0
 18  8  2  0  0  0  0
 19  8  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  2  0  0  0  0
 23 22  1  0  0  0  0
  6  3  1  0  0  0  0
 23 21  2  0  0  0  0
 20 13  2  0  0  0  0
M  END
>  <Mol_ID> (845)
845

>  <Formula> (845)
C18H15ClN2OS

>  <MolWeight> (845)
342.8425

>  <PCAT_CMPD_ID> (845)
WAY-334003

>  <CNC_ID> (845)
359332536

>  <transfer_container_id> (845)
PTN000000067

>  <COMPOUND_NUMBER> (845)
WAY-334003

>  <BAR_CODE_NO> (845)
309004

>  <LOCATION_CODE> (845)
PTNCS

>  <AMOUNT_CURRENT> (845)
32.5

$$$$
WAY-333988
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.2083    2.9708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
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 10  1  1  0  0  0  0
 11  3  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  1  0  0  0  0
 14  9  1  0  0  0  0
 15  9  2  0  0  0  0
 16 11  1  0  0  0  0
 17 11  2  0  0  0  0
 18 14  2  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 21 15  1  0  0  0  0
 22 20  2  0  0  0  0
 23 21  2  0  0  0  0
 18 23  1  0  0  0  0
  4  3  1  0  0  0  0
 22 19  1  0  0  0  0
M  END
>  <Mol_ID> (846)
846

>  <Formula> (846)
C17H16N2O2S2

>  <MolWeight> (846)
344.45114

>  <PCAT_CMPD_ID> (846)
WAY-333988

>  <CNC_ID> (846)
359332521

>  <transfer_container_id> (846)
PTN000000067

>  <COMPOUND_NUMBER> (846)
WAY-333988

>  <BAR_CODE_NO> (846)
308989

>  <LOCATION_CODE> (846)
PTNCS

>  <AMOUNT_CURRENT> (846)
32.5

$$$$
WAY-329034
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    2.4417   -9.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
 12 11  2  0  0  0  0
 13  5  1  0  0  0  0
 14  2  1  0  0  0  0
 15 12  1  0  0  0  0
 16 15  1  0  0  0  0
 17 18  2  0  0  0  0
 18 11  1  0  0  0  0
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 23 22  1  0  0  0  0
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 25 24  1  0  0  0  0
 26 23  1  0  0  0  0
  8  6  1  0  0  0  0
 19 15  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (847)
847

>  <Formula> (847)
C21H30N2O3

>  <MolWeight> (847)
358.4745

>  <PCAT_CMPD_ID> (847)
WAY-329034

>  <CNC_ID> (847)
359316399

>  <transfer_container_id> (847)
PTN000000065

>  <COMPOUND_NUMBER> (847)
WAY-329034

>  <BAR_CODE_NO> (847)
304035

>  <LOCATION_CODE> (847)
PTNCS

>  <AMOUNT_CURRENT> (847)
32.5

$$$$
WAY-643887
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
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  6  1  1  0  0  0  0
  7 10  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  4  1  0  0  0  0
 11 18  1  0  0  0  0
 12  2  1  0  0  0  0
 13  2  1  0  0  0  0
 14  4  1  0  0  0  0
 15  3  2  0  0  0  0
 16 14  1  0  0  0  0
 17  5  1  0  0  0  0
 18 13  1  0  0  0  0
 19 12  1  0  0  0  0
 20  6  1  0  0  0  0
 21  6  2  0  0  0  0
 22 24  2  0  0  0  0
 23 20  2  0  0  0  0
 24 21  1  0  0  0  0
 25 22  1  0  0  0  0
 26 17  1  0  0  0  0
 27 17  2  0  0  0  0
 28 27  1  0  0  0  0
 29 26  2  0  0  0  0
 30 28  2  0  0  0  0
 23 22  1  0  0  0  0
 11 19  1  0  0  0  0
  5  7  2  0  0  0  0
 30 29  1  0  0  0  0
M  END
>  <Mol_ID> (848)
848

>  <Formula> (848)
C23H25FN2O3S

>  <MolWeight> (848)
428.5196032

>  <PCAT_CMPD_ID> (848)
WAY-643887

>  <CNC_ID> (848)
359325626

>  <transfer_container_id> (848)
PTN000000065

>  <COMPOUND_NUMBER> (848)
WAY-643887

>  <BAR_CODE_NO> (848)
90478461

>  <LOCATION_CODE> (848)
PTNCS

>  <AMOUNT_CURRENT> (848)
32.4

$$$$
WAY-616403
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
    0.9833   -0.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  2  0  0  0  0
  6  4  2  0  0  0  0
  7  1  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  2  0  0  0  0
 11  9  2  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14 20  1  0  0  0  0
 15  3  1  0  0  0  0
 16  7  1  0  0  0  0
 17  7  1  0  0  0  0
 18 12  1  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  1  0  0  0  0
 21 14  1  0  0  0  0
  6  5  1  0  0  0  0
 11 10  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (849)
849

>  <Formula> (849)
C14H15N3O4

>  <MolWeight> (849)
289.2866

>  <PCAT_CMPD_ID> (849)
WAY-616403

>  <CNC_ID> (849)
359321488

>  <transfer_container_id> (849)
PTN000000065

>  <COMPOUND_NUMBER> (849)
WAY-616403

>  <BAR_CODE_NO> (849)
90450390

>  <LOCATION_CODE> (849)
PTNCS

>  <AMOUNT_CURRENT> (849)
32.3

$$$$
WAY-616400
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  2  2  0  0  0  0
 12  7  2  0  0  0  0
 13  3  1  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16  8  1  0  0  0  0
 17  9  1  0  0  0  0
 18 10  1  0  0  0  0
 19 14  2  0  0  0  0
 20 16  2  0  0  0  0
 21 18  2  0  0  0  0
 22 19  1  0  0  0  0
  6  9  1  0  0  0  0
 10  8  2  0  0  0  0
 17 22  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (850)
850

>  <Formula> (850)
C17H15N3O2

>  <MolWeight> (850)
293.3199

>  <PCAT_CMPD_ID> (850)
WAY-616400

>  <CNC_ID> (850)
359321485

>  <transfer_container_id> (850)
PTN000000065

>  <COMPOUND_NUMBER> (850)
WAY-616400

>  <BAR_CODE_NO> (850)
90450387

>  <LOCATION_CODE> (850)
PTNCS

>  <AMOUNT_CURRENT> (850)
32.5

$$$$
WAY-616088
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7  2  2  0  0  0  0
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 10  3  1  0  0  0  0
 11  5  1  0  0  0  0
 12  4  1  0  0  0  0
 13 19  2  0  0  0  0
 14  6  1  0  0  0  0
 15  6  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  2  0  0  0  0
 18 16  2  0  0  0  0
 19 17  1  0  0  0  0
 10 12  1  0  0  0  0
 13 18  1  0  0  0  0
M  END
>  <Mol_ID> (851)
851

>  <Formula> (851)
C12H12F2N2O3

>  <MolWeight> (851)
270.2320864

>  <PCAT_CMPD_ID> (851)
WAY-616088

>  <CNC_ID> (851)
359321173

>  <transfer_container_id> (851)
PTN000000065

>  <COMPOUND_NUMBER> (851)
WAY-616088

>  <BAR_CODE_NO> (851)
90450068

>  <LOCATION_CODE> (851)
PTNCS

>  <AMOUNT_CURRENT> (851)
32.5

$$$$
WAY-642782
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11  4  1  0  0  0  0
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 16  4  2  0  0  0  0
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 18  7  2  0  0  0  0
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 22  6  1  0  0  0  0
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M  END
>  <Mol_ID> (852)
852

>  <Formula> (852)
C24H29N3O5S

>  <MolWeight> (852)
471.56916

>  <PCAT_CMPD_ID> (852)
WAY-642782

>  <CNC_ID> (852)
359324520

>  <transfer_container_id> (852)
PTN000000065

>  <COMPOUND_NUMBER> (852)
WAY-642782

>  <BAR_CODE_NO> (852)
90477345

>  <LOCATION_CODE> (852)
PTNCS

>  <AMOUNT_CURRENT> (852)
32

$$$$
WAY-624882
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  3  1  0  0  0  0
 13  3  2  0  0  0  0
 14  5  2  0  0  0  0
 15  8  1  0  0  0  0
 16  8  2  0  0  0  0
 17 12  2  0  0  0  0
 18 12  1  0  0  0  0
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 27  6  1  0  0  0  0
 28  4  1  0  0  0  0
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 20  2  1  0  0  0  0
 21 24  2  0  0  0  0
M  END
>  <Mol_ID> (853)
853

>  <Formula> (853)
C24H28ClN3O4S

>  <MolWeight> (853)
490.01482

>  <PCAT_CMPD_ID> (853)
WAY-624882

>  <CNC_ID> (853)
359323303

>  <transfer_container_id> (853)
PTN000000065

>  <COMPOUND_NUMBER> (853)
WAY-624882

>  <BAR_CODE_NO> (853)
90459062

>  <LOCATION_CODE> (853)
PTNCS

>  <AMOUNT_CURRENT> (853)
32.6

$$$$
WAY-278515
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 11 15  2  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
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  9 13  1  0  0  0  0
 12 15  1  0  0  0  0
 18 21  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (854)
854

>  <Formula> (854)
C19H16O5

>  <MolWeight> (854)
324.32734

>  <PCAT_CMPD_ID> (854)
WAY-278515

>  <CNC_ID> (854)
359327235

>  <transfer_container_id> (854)
PTN000000067

>  <COMPOUND_NUMBER> (854)
WAY-278515

>  <BAR_CODE_NO> (854)
389169

>  <LOCATION_CODE> (854)
PTNCS

>  <AMOUNT_CURRENT> (854)
32.5

$$$$
WAY-278521
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 21 24  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (855)
855

>  <Formula> (855)
C21H18O6

>  <MolWeight> (855)
366.36402

>  <PCAT_CMPD_ID> (855)
WAY-278521

>  <CNC_ID> (855)
359327241

>  <transfer_container_id> (855)
PTN000000067

>  <COMPOUND_NUMBER> (855)
WAY-278521

>  <BAR_CODE_NO> (855)
389175

>  <LOCATION_CODE> (855)
PTNCS

>  <AMOUNT_CURRENT> (855)
28.1

$$$$
WAY-643431
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  3  2  0  0  0  0
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  4 10  1  0  0  0  0
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  6  1  1  0  0  0  0
  7 12  2  0  0  0  0
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 10 15  1  0  0  0  0
 11  4  2  0  0  0  0
 12  4  1  0  0  0  0
 13  8  1  0  0  0  0
 14  2  1  0  0  0  0
 15 18  1  0  0  0  0
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 20  3  1  0  0  0  0
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 22  6  1  0  0  0  0
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 28 26  2  0  0  0  0
  9  7  1  0  0  0  0
M  END
>  <Mol_ID> (856)
856

>  <Formula> (856)
C21H21ClN2O4

>  <MolWeight> (856)
400.85544

>  <PCAT_CMPD_ID> (856)
WAY-643431

>  <CNC_ID> (856)
359325169

>  <transfer_container_id> (856)
PTN000000065

>  <COMPOUND_NUMBER> (856)
WAY-643431

>  <BAR_CODE_NO> (856)
90478003

>  <LOCATION_CODE> (856)
PTNCS

>  <AMOUNT_CURRENT> (856)
32.5

$$$$
WAY-616165
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  6  2  1  0  0  0  0
  7 11  1  0  0  0  0
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 10  4  2  0  0  0  0
 11 14  1  0  0  0  0
 12  8  1  0  0  0  0
 13  9  2  0  0  0  0
 14 19  2  0  0  0  0
 15  7  1  0  0  0  0
 16  7  1  0  0  0  0
 17 13  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 17  1  0  0  0  0
 21 17  2  0  0  0  0
 22  2  1  0  0  0  0
 23  3  1  0  0  0  0
 24  5  1  0  0  0  0
 25 23  2  0  0  0  0
 26 25  1  0  0  0  0
  6  5  1  0  0  0  0
 24 26  2  0  0  0  0
 18 14  1  0  0  0  0
M  END
>  <Mol_ID> (857)
857

>  <Formula> (857)
C19H18F2N2O3

>  <MolWeight> (857)
360.3546264

>  <PCAT_CMPD_ID> (857)
WAY-616165

>  <CNC_ID> (857)
359321250

>  <transfer_container_id> (857)
PTN000000065

>  <COMPOUND_NUMBER> (857)
WAY-616165

>  <BAR_CODE_NO> (857)
90450145

>  <LOCATION_CODE> (857)
PTNCS

>  <AMOUNT_CURRENT> (857)
32.1

$$$$
WAY-330038
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -5.0917   12.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.6042   12.4167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  3  1  0  0  0  0
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  8 16  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15  5  1  0  0  0  0
 16 15  1  0  0  0  0
 17 13  1  0  0  0  0
 18 17  2  0  0  0  0
 19 20  1  0  0  0  0
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 22 18  1  0  0  0  0
 23 22  1  0  0  0  0
  5  6  1  0  0  0  0
 11 12  2  0  0  0  0
 21 18  1  0  0  0  0
M  END
>  <Mol_ID> (858)
858

>  <Formula> (858)
C17H17N3O2S

>  <MolWeight> (858)
327.40078

>  <PCAT_CMPD_ID> (858)
WAY-330038

>  <CNC_ID> (858)
359317404

>  <transfer_container_id> (858)
PTN000000065

>  <COMPOUND_NUMBER> (858)
WAY-330038

>  <BAR_CODE_NO> (858)
305039

>  <LOCATION_CODE> (858)
PTNCS

>  <AMOUNT_CURRENT> (858)
32.5

$$$$
WAY-278563
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.8920    1.0432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
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 17 19  1  0  0  0  0
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  9 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (859)
859

>  <Formula> (859)
C15H18N2O2

>  <MolWeight> (859)
258.31562

>  <PCAT_CMPD_ID> (859)
WAY-278563

>  <CNC_ID> (859)
359327283

>  <transfer_container_id> (859)
PTN000000067

>  <COMPOUND_NUMBER> (859)
WAY-278563

>  <BAR_CODE_NO> (859)
389218

>  <LOCATION_CODE> (859)
PTNCS

>  <AMOUNT_CURRENT> (859)
32.5

$$$$
WAY-330555
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
   14.1542  -11.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  5  2  0  0  0  0
 11  8  1  0  0  0  0
 12  9  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15  9  2  0  0  0  0
 16 15  1  0  0  0  0
 17 11  2  0  0  0  0
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 22 20  1  0  0  0  0
  6  7  1  0  0  0  0
  5  4  1  0  0  0  0
 21 22  2  0  0  0  0
 13 19  1  0  0  0  0
M  END
>  <Mol_ID> (860)
860

>  <Formula> (860)
C17H12FN3O

>  <MolWeight> (860)
293.2950832

>  <PCAT_CMPD_ID> (860)
WAY-330555

>  <CNC_ID> (860)
359317910

>  <transfer_container_id> (860)
PTN000000065

>  <COMPOUND_NUMBER> (860)
WAY-330555

>  <BAR_CODE_NO> (860)
305556

>  <LOCATION_CODE> (860)
PTNCS

>  <AMOUNT_CURRENT> (860)
32.5

$$$$
WAY-329488
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    2.9292   -0.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8 11  1  0  0  0  0
  9  4  1  0  0  0  0
 10  8  1  0  0  0  0
 11  6  1  0  0  0  0
 12 10  1  0  0  0  0
 13  6  2  0  0  0  0
 14 10  2  0  0  0  0
 15  7  2  0  0  0  0
 16 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18  3  1  0  0  0  0
 19  7  1  0  0  0  0
 20 22  1  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
  9  8  1  0  0  0  0
  5  2  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (861)
861

>  <Formula> (861)
C17H19NO5

>  <MolWeight> (861)
317.33646

>  <PCAT_CMPD_ID> (861)
WAY-329488

>  <CNC_ID> (861)
359316856

>  <transfer_container_id> (861)
PTN000000065

>  <COMPOUND_NUMBER> (861)
WAY-329488

>  <BAR_CODE_NO> (861)
304489

>  <LOCATION_CODE> (861)
PTNCS

>  <AMOUNT_CURRENT> (861)
32.5

$$$$
WAY-329485
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    4.0667   -0.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8 11  1  0  0  0  0
  9  4  1  0  0  0  0
 10  8  1  0  0  0  0
 11  6  1  0  0  0  0
 12 10  1  0  0  0  0
 13  6  2  0  0  0  0
 14 10  2  0  0  0  0
 15  7  2  0  0  0  0
 16 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18  3  1  0  0  0  0
 19  7  1  0  0  0  0
 20 23  1  0  0  0  0
 21 20  1  0  0  0  0
 22 19  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
 25 21  1  0  0  0  0
  9  8  1  0  0  0  0
  5  2  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (862)
862

>  <Formula> (862)
C19H23NO5

>  <MolWeight> (862)
345.38962

>  <PCAT_CMPD_ID> (862)
WAY-329485

>  <CNC_ID> (862)
359316853

>  <transfer_container_id> (862)
PTN000000065

>  <COMPOUND_NUMBER> (862)
WAY-329485

>  <BAR_CODE_NO> (862)
304486

>  <LOCATION_CODE> (862)
PTNCS

>  <AMOUNT_CURRENT> (862)
32.5

$$$$
WAY-331257
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    6.9542  -11.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  2  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  0  0  0  0
 13 16  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  2  0  0  0  0
 16 20  1  0  0  0  0
 17 13  2  0  0  0  0
 18  3  1  0  0  0  0
 19  4  1  0  0  0  0
 20 23  1  0  0  0  0
 21 22  1  0  0  0  0
 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
 24 13  1  0  0  0  0
 25 10  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  2  0  0  0  0
 28 26  1  0  0  0  0
 29 27  1  0  0  0  0
 30 28  2  0  0  0  0
 31 30  1  0  0  0  0
  8  9  1  0  0  0  0
  4  6  1  0  0  0  0
 16 21  1  0  0  0  0
 31 29  2  0  0  0  0
M  END
>  <Mol_ID> (863)
863

>  <Formula> (863)
C22H28N6O3

>  <MolWeight> (863)
424.49612

>  <PCAT_CMPD_ID> (863)
WAY-331257

>  <CNC_ID> (863)
359318612

>  <transfer_container_id> (863)
PTN000000065

>  <COMPOUND_NUMBER> (863)
WAY-331257

>  <BAR_CODE_NO> (863)
306258

>  <LOCATION_CODE> (863)
PTNCS

>  <AMOUNT_CURRENT> (863)
32.5

$$$$
WAY-329712
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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   10.6375   -8.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0167  -10.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -3.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  1  1  0  0  0  0
  8  7  2  0  0  0  0
  9  6  1  0  0  0  0
 10  3  1  0  0  0  0
 11 12  1  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15  9  1  0  0  0  0
 16 11  2  0  0  0  0
 17 13  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  2  0  0  0  0
  4  8  1  0  0  0  0
  9  5  2  0  0  0  0
 19 17  1  0  0  0  0
M  END
>  <Mol_ID> (864)
864

>  <Formula> (864)
C13H12ClN5

>  <MolWeight> (864)
273.72088

>  <PCAT_CMPD_ID> (864)
WAY-329712

>  <CNC_ID> (864)
359317080

>  <transfer_container_id> (864)
PTN000000065

>  <COMPOUND_NUMBER> (864)
WAY-329712

>  <BAR_CODE_NO> (864)
304713

>  <LOCATION_CODE> (864)
PTNCS

>  <AMOUNT_CURRENT> (864)
32.5

$$$$
WAY-329719
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
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 10 15  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  9  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  2  0  0  0  0
 18 17  1  0  0  0  0
 19  8  1  0  0  0  0
 20 11  1  0  0  0  0
 21 12  1  0  0  0  0
 22 17  1  0  0  0  0
 23 18  1  0  0  0  0
 24 21  2  0  0  0  0
 25 24  1  0  0  0  0
  4  8  1  0  0  0  0
 11  6  2  0  0  0  0
 10 16  1  0  0  0  0
 25 22  2  0  0  0  0
M  END
>  <Mol_ID> (865)
865

>  <Formula> (865)
C18H22N6O

>  <MolWeight> (865)
338.40688

>  <PCAT_CMPD_ID> (865)
WAY-329719

>  <CNC_ID> (865)
359317087

>  <transfer_container_id> (865)
PTN000000065

>  <COMPOUND_NUMBER> (865)
WAY-329719

>  <BAR_CODE_NO> (865)
304720

>  <LOCATION_CODE> (865)
PTNCS

>  <AMOUNT_CURRENT> (865)
32.5

$$$$
WL-231219
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
   -1.2908   -0.7231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (866)
866

>  <Formula> (866)
C10H12N4O2

>  <MolWeight> (866)
220.22788

>  <PCAT_CMPD_ID> (866)
WL-231219

>  <CNC_ID> (866)
359326675

>  <transfer_container_id> (866)
PTN000000065

>  <COMPOUND_NUMBER> (866)
WL-231219

>  <BAR_CODE_NO> (866)
90477449

>  <LOCATION_CODE> (866)
PTNCS

>  <AMOUNT_CURRENT> (866)
33

$$$$
WAY-332410
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (867)
867

>  <Formula> (867)
C27H29N5O

>  <MolWeight> (867)
439.55206

>  <PCAT_CMPD_ID> (867)
WAY-332410

>  <CNC_ID> (867)
359330946

>  <transfer_container_id> (867)
PTN000000067

>  <COMPOUND_NUMBER> (867)
WAY-332410

>  <BAR_CODE_NO> (867)
307411

>  <LOCATION_CODE> (867)
PTNCS

>  <AMOUNT_CURRENT> (867)
32.5

$$$$
WAY-329104
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (868)
868

>  <Formula> (868)
C24H29N3O4S

>  <MolWeight> (868)
455.56976

>  <PCAT_CMPD_ID> (868)
WAY-329104

>  <CNC_ID> (868)
359316469

>  <transfer_container_id> (868)
PTN000000065

>  <COMPOUND_NUMBER> (868)
WAY-329104

>  <BAR_CODE_NO> (868)
304105

>  <LOCATION_CODE> (868)
PTNCS

>  <AMOUNT_CURRENT> (868)
32.5

$$$$
WAY-643773
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (869)
869

>  <Formula> (869)
C20H23N5O3S

>  <MolWeight> (869)
413.49332

>  <PCAT_CMPD_ID> (869)
WAY-643773

>  <CNC_ID> (869)
359325511

>  <transfer_container_id> (869)
PTN000000065

>  <COMPOUND_NUMBER> (869)
WAY-643773

>  <BAR_CODE_NO> (869)
90478345

>  <LOCATION_CODE> (869)
PTNCS

>  <AMOUNT_CURRENT> (869)
32.1

$$$$
WAY-624857
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (870)
870

>  <Formula> (870)
C15H10Cl2N2O4

>  <MolWeight> (870)
353.1569

>  <PCAT_CMPD_ID> (870)
WAY-624857

>  <CNC_ID> (870)
359323278

>  <transfer_container_id> (870)
PTN000000065

>  <COMPOUND_NUMBER> (870)
WAY-624857

>  <BAR_CODE_NO> (870)
90459035

>  <LOCATION_CODE> (870)
PTNCS

>  <AMOUNT_CURRENT> (870)
32.4

$$$$
WAY-643387
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 18 12  1  0  0  0  0
 19  9  1  0  0  0  0
 20 15  1  0  0  0  0
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 22 17  1  0  0  0  0
 14 17  1  0  0  0  0
  5  7  2  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (871)
871

>  <Formula> (871)
C16H17N5O

>  <MolWeight> (871)
295.33908

>  <PCAT_CMPD_ID> (871)
WAY-643387

>  <CNC_ID> (871)
359325125

>  <transfer_container_id> (871)
PTN000000065

>  <COMPOUND_NUMBER> (871)
WAY-643387

>  <BAR_CODE_NO> (871)
90477958

>  <LOCATION_CODE> (871)
PTNCS

>  <AMOUNT_CURRENT> (871)
32.3

$$$$
WAY-616126
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15 20  1  0  0  0  0
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 17  3  1  0  0  0  0
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 22  7  1  0  0  0  0
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 21 15  1  0  0  0  0
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 11 12  2  0  0  0  0
 29 28  1  0  0  0  0
M  END
>  <Mol_ID> (872)
872

>  <Formula> (872)
C22H28N4O2S

>  <MolWeight> (872)
412.54832

>  <PCAT_CMPD_ID> (872)
WAY-616126

>  <CNC_ID> (872)
359321211

>  <transfer_container_id> (872)
PTN000000065

>  <COMPOUND_NUMBER> (872)
WAY-616126

>  <BAR_CODE_NO> (872)
90450106

>  <LOCATION_CODE> (872)
PTNCS

>  <AMOUNT_CURRENT> (872)
32.2

$$$$
WAY-624940
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  8  1  0  0  0  0
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 15  4  1  0  0  0  0
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 20 15  1  0  0  0  0
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 16 14  1  0  0  0  0
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 12 11  2  0  0  0  0
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M  END
>  <Mol_ID> (873)
873

>  <Formula> (873)
C21H16N4O

>  <MolWeight> (873)
340.37794

>  <PCAT_CMPD_ID> (873)
WAY-624940

>  <CNC_ID> (873)
359323361

>  <transfer_container_id> (873)
PTN000000065

>  <COMPOUND_NUMBER> (873)
WAY-624940

>  <BAR_CODE_NO> (873)
90459120

>  <LOCATION_CODE> (873)
PTNCS

>  <AMOUNT_CURRENT> (873)
32.6

$$$$
WAY-615922
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (874)
874

>  <Formula> (874)
C25H22FN3O2

>  <MolWeight> (874)
415.4594832

>  <PCAT_CMPD_ID> (874)
WAY-615922

>  <CNC_ID> (874)
359321007

>  <transfer_container_id> (874)
PTN000000065

>  <COMPOUND_NUMBER> (874)
WAY-615922

>  <BAR_CODE_NO> (874)
90449897

>  <LOCATION_CODE> (874)
PTNCS

>  <AMOUNT_CURRENT> (874)
32.6

$$$$
WAY-624895
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  9  1  1  0  0  0  0
 21  3  1  0  0  0  0
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 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
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 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
 12  4  1  0  0  0  0
  5 15  1  0  0  0  0
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 17 18  1  0  0  0  0
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 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (875)
875

>  <Formula> (875)
C15H15N5OS

>  <MolWeight> (875)
313.3775

>  <PCAT_CMPD_ID> (875)
WAY-624895

>  <CNC_ID> (875)
359323316

>  <transfer_container_id> (875)
PTN000000065

>  <COMPOUND_NUMBER> (875)
WAY-624895

>  <BAR_CODE_NO> (875)
90459075

>  <LOCATION_CODE> (875)
PTNCS

>  <AMOUNT_CURRENT> (875)
32.1

$$$$
WAY-623781
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  4  2  0  0  0  0
  8 18  1  0  0  0  0
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 10  2  1  0  0  0  0
 11  1  1  0  0  0  0
 12  7  1  0  0  0  0
 13  5  1  0  0  0  0
 14  4  1  0  0  0  0
 15 11  2  0  0  0  0
 16  5  2  0  0  0  0
 17  8  2  0  0  0  0
 18 14  1  0  0  0  0
 19  6  1  0  0  0  0
 20 13  1  0  0  0  0
 21 15  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
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 25 24  1  0  0  0  0
 26 23  2  0  0  0  0
 27 25  2  0  0  0  0
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 12 10  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (876)
876

>  <Formula> (876)
C18H14Cl2N4O3

>  <MolWeight> (876)
405.23476

>  <PCAT_CMPD_ID> (876)
WAY-623781

>  <CNC_ID> (876)
359322401

>  <transfer_container_id> (876)
PTN000000065

>  <COMPOUND_NUMBER> (876)
WAY-623781

>  <BAR_CODE_NO> (876)
90457952

>  <LOCATION_CODE> (876)
PTNCS

>  <AMOUNT_CURRENT> (876)
32.3

$$$$
WAY-329613
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  5  2  0  0  0  0
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 10  4  1  0  0  0  0
 11  3  2  0  0  0  0
 12  7  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15 12  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18  8  1  0  0  0  0
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 20 16  2  0  0  0  0
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 22 19  1  0  0  0  0
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 24 23  1  0  0  0  0
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 15 13  2  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (877)
877

>  <Formula> (877)
C19H17FO3S

>  <MolWeight> (877)
344.3998832

>  <PCAT_CMPD_ID> (877)
WAY-329613

>  <CNC_ID> (877)
359316981

>  <transfer_container_id> (877)
PTN000000065

>  <COMPOUND_NUMBER> (877)
WAY-329613

>  <BAR_CODE_NO> (877)
304614

>  <LOCATION_CODE> (877)
PTNCS

>  <AMOUNT_CURRENT> (877)
32.5

$$$$
WAY-643848
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 15  9  1  0  0  0  0
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 18 14  1  0  0  0  0
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 18 17  1  0  0  0  0
 11 12  2  0  0  0  0
M  END
>  <Mol_ID> (878)
878

>  <Formula> (878)
C13H14N2OS2

>  <MolWeight> (878)
278.39306

>  <PCAT_CMPD_ID> (878)
WAY-643848

>  <CNC_ID> (878)
359325587

>  <transfer_container_id> (878)
PTN000000065

>  <COMPOUND_NUMBER> (878)
WAY-643848

>  <BAR_CODE_NO> (878)
90478421

>  <LOCATION_CODE> (878)
PTNCS

>  <AMOUNT_CURRENT> (878)
32.6

$$$$
WAY-624770
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
 11  4  1  0  0  0  0
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 13  2  1  0  0  0  0
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 15  1  1  0  0  0  0
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 28  8  1  0  0  0  0
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 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (879)
879

>  <Formula> (879)
C23H21N3O5S

>  <MolWeight> (879)
451.49494

>  <PCAT_CMPD_ID> (879)
WAY-624770

>  <CNC_ID> (879)
359323191

>  <transfer_container_id> (879)
PTN000000065

>  <COMPOUND_NUMBER> (879)
WAY-624770

>  <BAR_CODE_NO> (879)
90458948

>  <LOCATION_CODE> (879)
PTNCS

>  <AMOUNT_CURRENT> (879)
33

$$$$
WAY-332270
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.9500   -4.4250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2000   -3.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.7500  -10.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  7  5  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  4  2  0  0  0  0
 13  2  2  0  0  0  0
 14 13  1  0  0  0  0
 15  9  2  0  0  0  0
 16  5  2  0  0  0  0
 17 15  1  0  0  0  0
 18  9  1  0  0  0  0
 19  3  1  0  0  0  0
 20 15  1  0  0  0  0
 21 22  1  0  0  0  0
 22 18  2  0  0  0  0
 23 24  1  0  0  0  0
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 25 21  1  0  0  0  0
 14 12  1  0  0  0  0
 23  6  1  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (880)
880

>  <Formula> (880)
C16H19BrN4O3S

>  <MolWeight> (880)
427.31606

>  <PCAT_CMPD_ID> (880)
WAY-332270

>  <CNC_ID> (880)
359330806

>  <transfer_container_id> (880)
PTN000000067

>  <COMPOUND_NUMBER> (880)
WAY-332270

>  <BAR_CODE_NO> (880)
307271

>  <LOCATION_CODE> (880)
PTNCS

>  <AMOUNT_CURRENT> (880)
32.5

$$$$
WAY-331228
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    3.6302    5.4939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6369    4.1028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  5  1  0  0  0  0
 10 11  1  0  0  0  0
 11  9  1  0  0  0  0
 12  5  1  0  0  0  0
 13  6  2  0  0  0  0
 14  7  2  0  0  0  0
 15 12  1  0  0  0  0
 16 10  1  0  0  0  0
 17 16  1  0  0  0  0
 18 23  1  0  0  0  0
 19 15  2  0  0  0  0
 20  3  1  0  0  0  0
 21  4  1  0  0  0  0
 22 10  1  0  0  0  0
 23 22  1  0  0  0  0
 24 15  1  0  0  0  0
 25 17  1  0  0  0  0
 26 18  1  0  0  0  0
 27 24  1  0  0  0  0
 28 27  1  0  0  0  0
 29 25  2  0  0  0  0
 30 26  2  0  0  0  0
  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 18 17  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (881)
881

>  <Formula> (881)
C21H25N5O4

>  <MolWeight> (881)
411.4543

>  <PCAT_CMPD_ID> (881)
WAY-331228

>  <CNC_ID> (881)
359318583

>  <transfer_container_id> (881)
PTN000000065

>  <COMPOUND_NUMBER> (881)
WAY-331228

>  <BAR_CODE_NO> (881)
306229

>  <LOCATION_CODE> (881)
PTNCS

>  <AMOUNT_CURRENT> (881)
32.5

$$$$
WAY-333805
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
  -11.8542    6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8542    7.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  2  0  0  0  0
  9  2  1  0  0  0  0
 10  6  1  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13 23  1  0  0  0  0
 14  5  2  0  0  0  0
 15 13  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 20 12  2  0  0  0  0
 21 11  1  0  0  0  0
 22 11  2  0  0  0  0
 23 16  1  0  0  0  0
 24 26  2  0  0  0  0
 25 21  2  0  0  0  0
 26 22  1  0  0  0  0
 27 24  1  0  0  0  0
  7  9  2  0  0  0  0
  5  6  1  0  0  0  0
 24 25  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (882)
882

>  <Formula> (882)
C18H14FN5O3

>  <MolWeight> (882)
367.3338632

>  <PCAT_CMPD_ID> (882)
WAY-333805

>  <CNC_ID> (882)
359332338

>  <transfer_container_id> (882)
PTN000000067

>  <COMPOUND_NUMBER> (882)
WAY-333805

>  <BAR_CODE_NO> (882)
308806

>  <LOCATION_CODE> (882)
PTNCS

>  <AMOUNT_CURRENT> (882)
32.5

$$$$
WAY-330241
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
    8.7515    8.9629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0385    8.5498    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2954    6.3529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  5  9  2  0  0  0  0
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  7  3  2  0  0  0  0
  8  6  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
 13  4  1  0  0  0  0
 14  2  1  0  0  0  0
 15 14  1  0  0  0  0
 16  6  1  0  0  0  0
 17 14  2  0  0  0  0
 18 10  2  0  0  0  0
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 20 15  2  0  0  0  0
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 23 13  1  0  0  0  0
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 28 25  2  0  0  0  0
 29 26  1  0  0  0  0
 30 29  2  0  0  0  0
 13  8  2  0  0  0  0
  5  3  1  0  0  0  0
 11 12  1  0  0  0  0
 30 28  1  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (883)
883

>  <Formula> (883)
C23H19N5O2

>  <MolWeight> (883)
397.42926

>  <PCAT_CMPD_ID> (883)
WAY-330241

>  <CNC_ID> (883)
359317606

>  <transfer_container_id> (883)
PTN000000065

>  <COMPOUND_NUMBER> (883)
WAY-330241

>  <BAR_CODE_NO> (883)
305242

>  <LOCATION_CODE> (883)
PTNCS

>  <AMOUNT_CURRENT> (883)
32.5

$$$$
WAY-333933
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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   -2.5500    5.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  9  1  0  0  0  0
  9  7  2  0  0  0  0
 10  1  1  0  0  0  0
 11  5  1  0  0  0  0
 12  4  2  0  0  0  0
 13 10  2  0  0  0  0
 14 11  2  0  0  0  0
 15  9  1  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
 18 10  1  0  0  0  0
 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 21 15  1  0  0  0  0
 22 15  1  0  0  0  0
 23 17  1  0  0  0  0
  2  6  1  0  0  0  0
 20 17  2  0  0  0  0
  8  5  2  0  0  0  0
M  END
>  <Mol_ID> (884)
884

>  <Formula> (884)
C16H17N5O2

>  <MolWeight> (884)
311.33848

>  <PCAT_CMPD_ID> (884)
WAY-333933

>  <CNC_ID> (884)
359332466

>  <transfer_container_id> (884)
PTN000000067

>  <COMPOUND_NUMBER> (884)
WAY-333933

>  <BAR_CODE_NO> (884)
308934

>  <LOCATION_CODE> (884)
PTNCS

>  <AMOUNT_CURRENT> (884)
32.5

$$$$
WAY-333943
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -2.3375    1.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
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  9  8  1  0  0  0  0
 10  5  1  0  0  0  0
 11  3  1  0  0  0  0
 12  4  2  0  0  0  0
 13  9  1  0  0  0  0
 14 10  2  0  0  0  0
 15 22  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  2  0  0  0  0
 18 10  1  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 21 20  2  0  0  0  0
 22 25  2  0  0  0  0
 23 24  1  0  0  0  0
 24 13  2  0  0  0  0
 25 13  1  0  0  0  0
 26 21  1  0  0  0  0
  4  3  1  0  0  0  0
  9  7  2  0  0  0  0
 15 23  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (885)
885

>  <Formula> (885)
C18H14N6O2

>  <MolWeight> (885)
346.34276

>  <PCAT_CMPD_ID> (885)
WAY-333943

>  <CNC_ID> (885)
359332476

>  <transfer_container_id> (885)
PTN000000067

>  <COMPOUND_NUMBER> (885)
WAY-333943

>  <BAR_CODE_NO> (885)
308944

>  <LOCATION_CODE> (885)
PTNCS

>  <AMOUNT_CURRENT> (885)
32.5

$$$$
WAY-278447
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   -1.4012    0.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
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 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  3  0  0  0  0
  5  9  1  0  0  0  0
 12 13  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (886)
886

>  <Formula> (886)
C17H8F3N3O2S2

>  <MolWeight> (886)
407.3895296

>  <PCAT_CMPD_ID> (886)
WAY-278447

>  <CNC_ID> (886)
359327167

>  <transfer_container_id> (886)
PTN000000067

>  <COMPOUND_NUMBER> (886)
WAY-278447

>  <BAR_CODE_NO> (886)
389102

>  <LOCATION_CODE> (886)
PTNCS

>  <AMOUNT_CURRENT> (886)
32.5

$$$$
WAY-331123
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   10.6875   -6.0750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.0750   -7.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3125   -4.9875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.7750   -6.6875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.4000   -1.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5 15  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  2  0  0  0  0
  9  4  2  0  0  0  0
 10  2  2  0  0  0  0
 11  3  1  0  0  0  0
 12  3  1  0  0  0  0
 13 10  1  0  0  0  0
 14  6  2  0  0  0  0
 15 12  1  0  0  0  0
 16 11  1  0  0  0  0
 17  6  1  0  0  0  0
 18 17  2  0  0  0  0
 19 14  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  1  0  0  0  0
 22 17  1  0  0  0  0
 16  5  1  0  0  0  0
 13  9  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (887)
887

>  <Formula> (887)
C14H17ClN4O2S

>  <MolWeight> (887)
340.82838

>  <PCAT_CMPD_ID> (887)
WAY-331123

>  <CNC_ID> (887)
359318478

>  <transfer_container_id> (887)
PTN000000065

>  <COMPOUND_NUMBER> (887)
WAY-331123

>  <BAR_CODE_NO> (887)
306124

>  <LOCATION_CODE> (887)
PTNCS

>  <AMOUNT_CURRENT> (887)
32.5

$$$$
WAY-333794
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
  -11.8542    6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 10  1  0  0  0  0
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 13  5  1  0  0  0  0
 14  4  1  0  0  0  0
 15  6  2  0  0  0  0
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 27 24  1  0  0  0  0
 28 21  2  0  0  0  0
 29 21  1  0  0  0  0
 30 29  2  0  0  0  0
 31 28  1  0  0  0  0
 32 30  1  0  0  0  0
  7  9  2  0  0  0  0
  6  5  1  0  0  0  0
 24 26  2  0  0  0  0
 12 19  1  0  0  0  0
 32 31  2  0  0  0  0
M  END
>  <Mol_ID> (888)
888

>  <Formula> (888)
C23H21FN6O2

>  <MolWeight> (888)
432.4502432

>  <PCAT_CMPD_ID> (888)
WAY-333794

>  <CNC_ID> (888)
359332327

>  <transfer_container_id> (888)
PTN000000067

>  <COMPOUND_NUMBER> (888)
WAY-333794

>  <BAR_CODE_NO> (888)
308795

>  <LOCATION_CODE> (888)
PTNCS

>  <AMOUNT_CURRENT> (888)
32.5

$$$$
WAY-642919
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    0.1375    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  8  1  0  0  0  0
  8 12  2  0  0  0  0
  9  3  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  2  0  0  0  0
 12  9  1  0  0  0  0
 13  7  1  0  0  0  0
 14 16  3  0  0  0  0
 15 11  1  0  0  0  0
 16 19  1  0  0  0  0
 17  7  2  0  0  0  0
 18 13  1  0  0  0  0
 19 25  1  0  0  0  0
 20  5  1  0  0  0  0
 21  6  1  0  0  0  0
 22  8  1  0  0  0  0
 23 18  2  0  0  0  0
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 25 24  2  0  0  0  0
 26 23  1  0  0  0  0
 27 12  1  0  0  0  0
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 29 27  2  0  0  0  0
  4  6  1  0  0  0  0
 15 10  2  0  0  0  0
 28 22  2  0  0  0  0
 19 26  2  0  0  0  0
M  END
>  <Mol_ID> (889)
889

>  <Formula> (889)
C22H16N4OS2

>  <MolWeight> (889)
416.51864

>  <PCAT_CMPD_ID> (889)
WAY-642919

>  <CNC_ID> (889)
359324657

>  <transfer_container_id> (889)
PTN000000065

>  <COMPOUND_NUMBER> (889)
WAY-642919

>  <BAR_CODE_NO> (889)
90477485

>  <LOCATION_CODE> (889)
PTNCS

>  <AMOUNT_CURRENT> (889)
32.1

$$$$
WAY-334031
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.0292    2.4250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3125    3.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3042    1.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  5  1  0  0  0  0
  4  7  1  0  0  0  0
  5 14  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  2  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  6  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14  8  1  0  0  0  0
 15 13  2  0  0  0  0
 16  6  1  0  0  0  0
 17 10  1  0  0  0  0
 18 16  2  0  0  0  0
 19 18  1  0  0  0  0
 20 10  1  0  0  0  0
 21 19  1  0  0  0  0
 17 19  2  0  0  0  0
  2  4  1  0  0  0  0
  9 15  1  0  0  0  0
M  END
>  <Mol_ID> (890)
890

>  <Formula> (890)
C14H15N3O2S2

>  <MolWeight> (890)
321.4178

>  <PCAT_CMPD_ID> (890)
WAY-334031

>  <CNC_ID> (890)
359332564

>  <transfer_container_id> (890)
PTN000000067

>  <COMPOUND_NUMBER> (890)
WAY-334031

>  <BAR_CODE_NO> (890)
309032

>  <LOCATION_CODE> (890)
PTNCS

>  <AMOUNT_CURRENT> (890)
32.5

$$$$
WAY-330384
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.7750   -9.9625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5 10  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10 15  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  1  0  0  0  0
 13  5  2  0  0  0  0
 14 11  1  0  0  0  0
 15 12  1  0  0  0  0
 16  4  1  0  0  0  0
 17  2  1  0  0  0  0
 18  8  1  0  0  0  0
 19 17  2  0  0  0  0
 20  9  2  0  0  0  0
 21 19  1  0  0  0  0
 22 16  1  0  0  0  0
 23 18  1  0  0  0  0
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 25 22  2  0  0  0  0
 26 23  1  0  0  0  0
 10 14  1  0  0  0  0
 21 16  2  0  0  0  0
 25 20  1  0  0  0  0
M  END
>  <Mol_ID> (891)
891

>  <Formula> (891)
C19H25N3O3S

>  <MolWeight> (891)
375.4851

>  <PCAT_CMPD_ID> (891)
WAY-330384

>  <CNC_ID> (891)
359317739

>  <transfer_container_id> (891)
PTN000000065

>  <COMPOUND_NUMBER> (891)
WAY-330384

>  <BAR_CODE_NO> (891)
305385

>  <LOCATION_CODE> (891)
PTNCS

>  <AMOUNT_CURRENT> (891)
32.5

$$$$
WAY-663281
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.1958    0.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
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 10  9  2  0  0  0  0
 11  7  2  0  0  0  0
 12  8  1  0  0  0  0
 13  8  2  0  0  0  0
 14 16  2  0  0  0  0
 15 12  2  0  0  0  0
 16 13  1  0  0  0  0
 17  6  1  0  0  0  0
 18 14  1  0  0  0  0
 19 10  1  0  0  0  0
 20  9  1  0  0  0  0
 21 18  1  0  0  0  0
 22 23  1  0  0  0  0
 23 20  2  0  0  0  0
  6  3  2  0  0  0  0
 15 14  1  0  0  0  0
 22 19  2  0  0  0  0
M  END
>  <Mol_ID> (892)
892

>  <Formula> (892)
C17H15N3O2S

>  <MolWeight> (892)
325.3849

>  <PCAT_CMPD_ID> (892)
WAY-663281

>  <CNC_ID> (892)
359326184

>  <transfer_container_id> (892)
PTN000000065

>  <COMPOUND_NUMBER> (892)
WAY-663281

>  <BAR_CODE_NO> (892)
90498028

>  <LOCATION_CODE> (892)
PTNCS

>  <AMOUNT_CURRENT> (892)
32.6

$$$$
WAY-330390
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
    6.2250   -7.9625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 14  5  1  0  0  0  0
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 22  6  1  0  0  0  0
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 30 25  1  0  0  0  0
  7 16  1  0  0  0  0
 31 33  2  0  0  0  0
M  END
>  <Mol_ID> (893)
893

>  <Formula> (893)
C25H28N4O3S

>  <MolWeight> (893)
464.57982

>  <PCAT_CMPD_ID> (893)
WAY-330390

>  <CNC_ID> (893)
359317745

>  <transfer_container_id> (893)
PTN000000065

>  <COMPOUND_NUMBER> (893)
WAY-330390

>  <BAR_CODE_NO> (893)
305391

>  <LOCATION_CODE> (893)
PTNCS

>  <AMOUNT_CURRENT> (893)
32.5

$$$$
WAY-330381
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10 17  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  1  0  0  0  0
 13 14  1  0  0  0  0
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 15  5  2  0  0  0  0
 16 13  2  0  0  0  0
 17 12  1  0  0  0  0
 18 11  1  0  0  0  0
 19  4  1  0  0  0  0
 20  6  1  0  0  0  0
 21 24  1  0  0  0  0
 22 25  2  0  0  0  0
 23  2  1  0  0  0  0
 24 20  2  0  0  0  0
 25 20  1  0  0  0  0
 26 23  2  0  0  0  0
 27  9  2  0  0  0  0
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 31 30  2  0  0  0  0
 10 18  1  0  0  0  0
 29 19  2  0  0  0  0
 31 27  1  0  0  0  0
 14 21  2  0  0  0  0
M  END
>  <Mol_ID> (894)
894

>  <Formula> (894)
C23H23N3O4S

>  <MolWeight> (894)
437.51142

>  <PCAT_CMPD_ID> (894)
WAY-330381

>  <CNC_ID> (894)
359317736

>  <transfer_container_id> (894)
PTN000000065

>  <COMPOUND_NUMBER> (894)
WAY-330381

>  <BAR_CODE_NO> (894)
305382

>  <LOCATION_CODE> (894)
PTNCS

>  <AMOUNT_CURRENT> (894)
32.5

$$$$
WAY-331132
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   10.4125   -5.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5 13  1  0  0  0  0
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 10  2  2  0  0  0  0
 11 10  1  0  0  0  0
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 13 20  1  0  0  0  0
 14  6  1  0  0  0  0
 15  3  1  0  0  0  0
 16  3  1  0  0  0  0
 17 14  2  0  0  0  0
 18  5  2  0  0  0  0
 19 22  1  0  0  0  0
 20 16  1  0  0  0  0
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 23 14  1  0  0  0  0
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 25 19  1  0  0  0  0
 13 21  1  0  0  0  0
  9 11  1  0  0  0  0
 19 12  2  0  0  0  0
M  END
>  <Mol_ID> (895)
895

>  <Formula> (895)
C17H22N4O3S

>  <MolWeight> (895)
362.44658

>  <PCAT_CMPD_ID> (895)
WAY-331132

>  <CNC_ID> (895)
359318487

>  <transfer_container_id> (895)
PTN000000065

>  <COMPOUND_NUMBER> (895)
WAY-331132

>  <BAR_CODE_NO> (895)
306133

>  <LOCATION_CODE> (895)
PTNCS

>  <AMOUNT_CURRENT> (895)
32.5

$$$$
WAY-334224
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 10 23  1  0  0  0  0
 11  6  1  0  0  0  0
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 14  1  1  0  0  0  0
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 22  5  1  0  0  0  0
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 26 21  1  0  0  0  0
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  6 10  2  0  0  0  0
 18 13  1  0  0  0  0
M  END
>  <Mol_ID> (896)
896

>  <Formula> (896)
C25H26N4O3

>  <MolWeight> (896)
430.49894

>  <PCAT_CMPD_ID> (896)
WAY-334224

>  <CNC_ID> (896)
359332757

>  <transfer_container_id> (896)
PTN000000067

>  <COMPOUND_NUMBER> (896)
WAY-334224

>  <BAR_CODE_NO> (896)
309225

>  <LOCATION_CODE> (896)
PTNCS

>  <AMOUNT_CURRENT> (896)
32.5

$$$$
WAY-334234
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 27 26  2  0  0  0  0
 28  9  2  0  0  0  0
 29 32  2  0  0  0  0
 30 27  1  0  0  0  0
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 32 28  1  0  0  0  0
  2 13  1  0  0  0  0
 29 16  1  0  0  0  0
 20 21  2  0  0  0  0
 19 30  2  0  0  0  0
M  END
>  <Mol_ID> (897)
897

>  <Formula> (897)
C25H27ClN4O2

>  <MolWeight> (897)
450.96048

>  <PCAT_CMPD_ID> (897)
WAY-334234

>  <CNC_ID> (897)
359332767

>  <transfer_container_id> (897)
PTN000000067

>  <COMPOUND_NUMBER> (897)
WAY-334234

>  <BAR_CODE_NO> (897)
309235

>  <LOCATION_CODE> (897)
PTNCS

>  <AMOUNT_CURRENT> (897)
32.5

$$$$
WAY-334237
csChFnd80/10111816222D

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  4  1  1  0  0  0  0
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  8  5  2  0  0  0  0
  9  4  1  0  0  0  0
 10  2  1  0  0  0  0
 11 23  1  0  0  0  0
 12  6  1  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
 15  1  1  0  0  0  0
 16  1  1  0  0  0  0
 17 16  1  0  0  0  0
 18 15  1  0  0  0  0
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 20  3  2  0  0  0  0
 21 29  2  0  0  0  0
 22  5  1  0  0  0  0
 23 22  2  0  0  0  0
 24 10  1  0  0  0  0
 25 10  2  0  0  0  0
 26 27  2  0  0  0  0
 27 25  1  0  0  0  0
 28 24  2  0  0  0  0
 29 13  1  0  0  0  0
 30 26  1  0  0  0  0
 31 13  2  0  0  0  0
 32 34  2  0  0  0  0
 33 30  1  0  0  0  0
 34 31  1  0  0  0  0
  2 18  1  0  0  0  0
 32 21  1  0  0  0  0
 26 28  1  0  0  0  0
  6 11  2  0  0  0  0
 19 14  1  0  0  0  0
M  END
>  <Mol_ID> (898)
898

>  <Formula> (898)
C26H28N4O4

>  <MolWeight> (898)
460.52492

>  <PCAT_CMPD_ID> (898)
WAY-334237

>  <CNC_ID> (898)
359332770

>  <transfer_container_id> (898)
PTN000000067

>  <COMPOUND_NUMBER> (898)
WAY-334237

>  <BAR_CODE_NO> (898)
309238

>  <LOCATION_CODE> (898)
PTNCS

>  <AMOUNT_CURRENT> (898)
32.5

$$$$
WAY-334248
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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   -3.2125    5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  1  1  0  0  0  0
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 15  4  2  0  0  0  0
 16  3  2  0  0  0  0
 17  9  1  0  0  0  0
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 19  7  2  0  0  0  0
 20 15  1  0  0  0  0
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 23  7  1  0  0  0  0
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 28 24  1  0  0  0  0
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  2 13  1  0  0  0  0
 30 26  2  0  0  0  0
 25 18  1  0  0  0  0
 20 17  2  0  0  0  0
M  END
>  <Mol_ID> (899)
899

>  <Formula> (899)
C23H26N4O3

>  <MolWeight> (899)
406.47754

>  <PCAT_CMPD_ID> (899)
WAY-334248

>  <CNC_ID> (899)
359332781

>  <transfer_container_id> (899)
PTN000000067

>  <COMPOUND_NUMBER> (899)
WAY-334248

>  <BAR_CODE_NO> (899)
309249

>  <LOCATION_CODE> (899)
PTNCS

>  <AMOUNT_CURRENT> (899)
32.5

$$$$
WAY-334250
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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   -5.8083    4.5250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0  0
 11 10  1  0  0  0  0
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 15  3  1  0  0  0  0
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  2 12  1  0  0  0  0
 24 14  1  0  0  0  0
 18 20  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (900)
900

>  <Formula> (900)
C24H31FN4O

>  <MolWeight> (900)
410.5275432

>  <PCAT_CMPD_ID> (900)
WAY-334250

>  <CNC_ID> (900)
359332783

>  <transfer_container_id> (900)
PTN000000067

>  <COMPOUND_NUMBER> (900)
WAY-334250

>  <BAR_CODE_NO> (900)
309251

>  <LOCATION_CODE> (900)
PTNCS

>  <AMOUNT_CURRENT> (900)
32.5

$$$$
WAY-334293
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 22 11  1  0  0  0  0
 23 24  1  0  0  0  0
 24 22  2  0  0  0  0
 25 21  1  0  0  0  0
 26 23  1  0  0  0  0
 27 12  1  0  0  0  0
 28 12  2  0  0  0  0
 29 30  2  0  0  0  0
 30 28  1  0  0  0  0
 18 20  2  0  0  0  0
 17  5  1  0  0  0  0
 19 29  1  0  0  0  0
 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (901)
901

>  <Formula> (901)
C21H23FN4O2S2

>  <MolWeight> (901)
446.5613232

>  <PCAT_CMPD_ID> (901)
WAY-334293

>  <CNC_ID> (901)
359332826

>  <transfer_container_id> (901)
PTN000000067

>  <COMPOUND_NUMBER> (901)
WAY-334293

>  <BAR_CODE_NO> (901)
309294

>  <LOCATION_CODE> (901)
PTNCS

>  <AMOUNT_CURRENT> (901)
32.5

$$$$
WAY-334296
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    9.2542   -3.7125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6792   -3.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1167    0.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
 13 12  1  0  0  0  0
 14 11  1  0  0  0  0
 15 23  2  0  0  0  0
 16  7  1  0  0  0  0
 17  7  2  0  0  0  0
 18  1  1  0  0  0  0
 19 21  2  0  0  0  0
 20 16  2  0  0  0  0
 21 17  1  0  0  0  0
 22 19  1  0  0  0  0
 23 10  1  0  0  0  0
 24 10  2  0  0  0  0
 25 27  2  0  0  0  0
 26 18  1  0  0  0  0
 27 24  1  0  0  0  0
 14  3  1  0  0  0  0
 15 25  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (902)
902

>  <Formula> (902)
C19H25FN4O2S

>  <MolWeight> (902)
392.4908032

>  <PCAT_CMPD_ID> (902)
WAY-334296

>  <CNC_ID> (902)
359332829

>  <transfer_container_id> (902)
PTN000000067

>  <COMPOUND_NUMBER> (902)
WAY-334296

>  <BAR_CODE_NO> (902)
309297

>  <LOCATION_CODE> (902)
PTNCS

>  <AMOUNT_CURRENT> (902)
32.5

$$$$
WAY-334305
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    9.6125   -2.5250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    8.8917   -2.1167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0167   -1.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2000   -3.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3292   -2.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 12  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  4  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15  7  2  0  0  0  0
 16 19  2  0  0  0  0
 17  1  1  0  0  0  0
 18 15  1  0  0  0  0
 19 10  1  0  0  0  0
 20  7  1  0  0  0  0
 21 10  2  0  0  0  0
 22 25  2  0  0  0  0
 23 15  1  0  0  0  0
 24 17  1  0  0  0  0
 25 21  1  0  0  0  0
 26 20  2  0  0  0  0
 27 26  1  0  0  0  0
 11  2  1  0  0  0  0
 16 22  1  0  0  0  0
 23 27  2  0  0  0  0
M  END
>  <Mol_ID> (903)
903

>  <Formula> (903)
C19H25FN4O2S

>  <MolWeight> (903)
392.4908032

>  <PCAT_CMPD_ID> (903)
WAY-334305

>  <CNC_ID> (903)
359332838

>  <transfer_container_id> (903)
PTN000000067

>  <COMPOUND_NUMBER> (903)
WAY-334305

>  <BAR_CODE_NO> (903)
309306

>  <LOCATION_CODE> (903)
PTNCS

>  <AMOUNT_CURRENT> (903)
32.5

$$$$
WAY-334311
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
    3.2875  -11.5167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1667  -11.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0875   -9.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0250   -9.6792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9417   -6.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9417   -2.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  2  0  0  0  0
  6  8  1  0  0  0  0
  7  6  1  0  0  0  0
  8 13  1  0  0  0  0
  9  7  2  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  1  0  0  0  0
 13 21  1  0  0  0  0
 14  9  1  0  0  0  0
 15  8  2  0  0  0  0
 16  7  1  0  0  0  0
 17  5  1  0  0  0  0
 18 17  2  0  0  0  0
 19  3  1  0  0  0  0
 20  9  1  0  0  0  0
 21 12  1  0  0  0  0
 22 23  1  0  0  0  0
 23 16  2  0  0  0  0
 24 17  1  0  0  0  0
 25 22  1  0  0  0  0
 18  4  1  0  0  0  0
 14 22  2  0  0  0  0
M  END
>  <Mol_ID> (904)
904

>  <Formula> (904)
C15H16BrClN4O3S

>  <MolWeight> (904)
447.73454

>  <PCAT_CMPD_ID> (904)
WAY-334311

>  <CNC_ID> (904)
359332844

>  <transfer_container_id> (904)
PTN000000067

>  <COMPOUND_NUMBER> (904)
WAY-334311

>  <BAR_CODE_NO> (904)
309312

>  <LOCATION_CODE> (904)
PTNCS

>  <AMOUNT_CURRENT> (904)
32.5

$$$$
WAY-331218
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   -6.4042    6.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3917    4.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2917    3.5083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  5  1  0  0  0  0
 10  5  1  0  0  0  0
 11  9  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  2  0  0  0  0
 14 11  1  0  0  0  0
 15  3  1  0  0  0  0
 16  4  1  0  0  0  0
 17 14  1  0  0  0  0
 18 10  1  0  0  0  0
 19 23  1  0  0  0  0
 20 18  2  0  0  0  0
 21 18  1  0  0  0  0
 22 17  1  0  0  0  0
 23 21  2  0  0  0  0
 24 20  1  0  0  0  0
 25 14  1  0  0  0  0
 26 19  1  0  0  0  0
 27 22  2  0  0  0  0
 28 22  1  0  0  0  0
 29 28  2  0  0  0  0
 30 27  1  0  0  0  0
 31 29  1  0  0  0  0
  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 19 24  2  0  0  0  0
 31 30  2  0  0  0  0
M  END
>  <Mol_ID> (905)
905

>  <Formula> (905)
C24H27N5O2

>  <MolWeight> (905)
417.50348

>  <PCAT_CMPD_ID> (905)
WAY-331218

>  <CNC_ID> (905)
359318573

>  <transfer_container_id> (905)
PTN000000065

>  <COMPOUND_NUMBER> (905)
WAY-331218

>  <BAR_CODE_NO> (905)
306219

>  <LOCATION_CODE> (905)
PTNCS

>  <AMOUNT_CURRENT> (905)
32.5

$$$$
WAY-334063
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.0750   -7.9167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.6125   -7.9167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6917  -10.5875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.5375   -7.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4375   -7.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  8  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  3  1  0  0  0  0
 11 16  2  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15 13  2  0  0  0  0
 16 14  1  0  0  0  0
 17  7  2  0  0  0  0
 18  7  1  0  0  0  0
 19  9  2  0  0  0  0
 20  9  1  0  0  0  0
 21 20  2  0  0  0  0
 22 19  1  0  0  0  0
 23 17  1  0  0  0  0
 24 18  2  0  0  0  0
 25 21  1  0  0  0  0
 26 24  1  0  0  0  0
 26 23  2  0  0  0  0
 25 22  2  0  0  0  0
 15 11  1  0  0  0  0
M  END
>  <Mol_ID> (906)
906

>  <Formula> (906)
C20H19ClN2O2S

>  <MolWeight> (906)
386.89506

>  <PCAT_CMPD_ID> (906)
WAY-334063

>  <CNC_ID> (906)
359332596

>  <transfer_container_id> (906)
PTN000000067

>  <COMPOUND_NUMBER> (906)
WAY-334063

>  <BAR_CODE_NO> (906)
309064

>  <LOCATION_CODE> (906)
PTNCS

>  <AMOUNT_CURRENT> (906)
32.5

$$$$
WAY-334141
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  3  2  0  0  0  0
  6 13  1  0  0  0  0
  7  6  2  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  2  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  8  1  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
 16 14  2  0  0  0  0
 17 15  2  0  0  0  0
 18 10  1  0  0  0  0
 19  9  2  0  0  0  0
 20 10  1  0  0  0  0
 21 18  2  0  0  0  0
 22 19  1  0  0  0  0
 19 21  1  0  0  0  0
  4  5  1  0  0  0  0
 17 16  1  0  0  0  0
M  END
>  <Mol_ID> (907)
907

>  <Formula> (907)
C14H11F2N3O2S

>  <MolWeight> (907)
323.3178464

>  <PCAT_CMPD_ID> (907)
WAY-334141

>  <CNC_ID> (907)
359332674

>  <transfer_container_id> (907)
PTN000000067

>  <COMPOUND_NUMBER> (907)
WAY-334141

>  <BAR_CODE_NO> (907)
309142

>  <LOCATION_CODE> (907)
PTNCS

>  <AMOUNT_CURRENT> (907)
32.5

$$$$
WAY-334693-A
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  3  2  0  0  0  0
  7  4  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
 12  2  1  0  0  0  0
 13  8  2  0  0  0  0
 14 13  1  0  0  0  0
 15 10  1  0  0  0  0
 16 12  2  0  0  0  0
 17 11  1  0  0  0  0
 18 16  1  0  0  0  0
 19 12  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
  5  7  1  0  0  0  0
 15  6  1  0  0  0  0
 14 11  2  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (908)
908

>  <Formula> (908)
C15H11BrN4OS2

>  <MolWeight> (908)
407.30804

>  <PCAT_CMPD_ID> (908)
WAY-334693-A

>  <CNC_ID> (908)
359333223

>  <transfer_container_id> (908)
PTN000000067

>  <COMPOUND_NUMBER> (908)
WAY-334693-A

>  <BAR_CODE_NO> (908)
309694

>  <LOCATION_CODE> (908)
PTNCS

>  <AMOUNT_CURRENT> (908)
32.5

$$$$
WAY-334786
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    6.8625   -5.6042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10 12  1  0  0  0  0
 11  3  1  0  0  0  0
 12 13  1  0  0  0  0
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 14 10  2  0  0  0  0
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 17 11  1  0  0  0  0
 18 15  2  0  0  0  0
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 20  7  1  0  0  0  0
 21 18  1  0  0  0  0
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 23 15  1  0  0  0  0
 24  8  1  0  0  0  0
 25  9  1  0  0  0  0
 26 23  1  0  0  0  0
 27 20  2  0  0  0  0
 28 25  2  0  0  0  0
  4  8  1  0  0  0  0
  9  7  2  0  0  0  0
 28 27  1  0  0  0  0
 21 19  2  0  0  0  0
M  END
>  <Mol_ID> (909)
909

>  <Formula> (909)
C19H16ClN5O2S

>  <MolWeight> (909)
413.88064

>  <PCAT_CMPD_ID> (909)
WAY-334786

>  <CNC_ID> (909)
359333316

>  <transfer_container_id> (909)
PTN000000067

>  <COMPOUND_NUMBER> (909)
WAY-334786

>  <BAR_CODE_NO> (909)
309787

>  <LOCATION_CODE> (909)
PTNCS

>  <AMOUNT_CURRENT> (909)
32.5

$$$$
WAY-334805
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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 24 21  2  0  0  0  0
 25  7  1  0  0  0  0
 26 24  1  0  0  0  0
 27  9  1  0  0  0  0
 28 13  1  0  0  0  0
 29 30  1  0  0  0  0
 30 20  2  0  0  0  0
 31 29  2  0  0  0  0
 32 25  2  0  0  0  0
 33 27  2  0  0  0  0
  8  4  1  0  0  0  0
  7  9  2  0  0  0  0
 32 33  1  0  0  0  0
 11 17  1  0  0  0  0
 31 24  1  0  0  0  0
M  END
>  <Mol_ID> (910)
910

>  <Formula> (910)
C23H20ClN7OS

>  <MolWeight> (910)
477.9692

>  <PCAT_CMPD_ID> (910)
WAY-334805

>  <CNC_ID> (910)
359333335

>  <transfer_container_id> (910)
PTN000000067

>  <COMPOUND_NUMBER> (910)
WAY-334805

>  <BAR_CODE_NO> (910)
309806

>  <LOCATION_CODE> (910)
PTNCS

>  <AMOUNT_CURRENT> (910)
32.5

$$$$
WAY-334807
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
    8.1500   -4.9125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1500   -3.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9375   -5.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5042   -2.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2250   -2.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3292  -11.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5042   -1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
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  7  2  1  0  0  0  0
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  9  6  1  0  0  0  0
 10 21  1  0  0  0  0
 11 15  2  0  0  0  0
 12  3  1  0  0  0  0
 13 10  1  0  0  0  0
 14 18  1  0  0  0  0
 15 10  1  0  0  0  0
 16 14  1  0  0  0  0
 17  8  1  0  0  0  0
 18 25  1  0  0  0  0
 19 13  2  0  0  0  0
 20 16  1  0  0  0  0
 21 17  1  0  0  0  0
 22 20  2  0  0  0  0
 23 18  2  0  0  0  0
 24 16  2  0  0  0  0
 25 12  1  0  0  0  0
 26 28  2  0  0  0  0
 27  7  1  0  0  0  0
 28 24  1  0  0  0  0
 29  9  1  0  0  0  0
 30 13  1  0  0  0  0
 31 20  1  0  0  0  0
 32 26  1  0  0  0  0
 33 27  2  0  0  0  0
 34 29  2  0  0  0  0
  8  4  1  0  0  0  0
  9  7  2  0  0  0  0
 33 34  1  0  0  0  0
 11 19  1  0  0  0  0
 22 26  1  0  0  0  0
M  END
>  <Mol_ID> (911)
911

>  <Formula> (911)
C25H25N7OS

>  <MolWeight> (911)
471.5773

>  <PCAT_CMPD_ID> (911)
WAY-334807

>  <CNC_ID> (911)
359333337

>  <transfer_container_id> (911)
PTN000000067

>  <COMPOUND_NUMBER> (911)
WAY-334807

>  <BAR_CODE_NO> (911)
309808

>  <LOCATION_CODE> (911)
PTNCS

>  <AMOUNT_CURRENT> (911)
32.5

$$$$
WAY-334810
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.0125   -3.6750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.2917   -4.9125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5750   -4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4250   -4.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1667   -2.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  2  0  0  0  0
  7 10  1  0  0  0  0
  8  6  1  0  0  0  0
  9  5  1  0  0  0  0
 10 16  1  0  0  0  0
 11 14  3  0  0  0  0
 12  3  2  0  0  0  0
 13  1  1  0  0  0  0
 14 19  1  0  0  0  0
 15  2  1  0  0  0  0
 16  9  2  0  0  0  0
 17  7  2  0  0  0  0
 18  7  1  0  0  0  0
 19 15  1  0  0  0  0
 20 13  1  0  0  0  0
 21 13  1  0  0  0  0
 22 18  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
 25 24  1  0  0  0  0
  4  6  1  0  0  0  0
 23 25  1  0  0  0  0
 10  8  2  0  0  0  0
M  END
>  <Mol_ID> (912)
912

>  <Formula> (912)
C18H19N3O3S

>  <MolWeight> (912)
357.42676

>  <PCAT_CMPD_ID> (912)
WAY-334810

>  <CNC_ID> (912)
359333340

>  <transfer_container_id> (912)
PTN000000067

>  <COMPOUND_NUMBER> (912)
WAY-334810

>  <BAR_CODE_NO> (912)
309811

>  <LOCATION_CODE> (912)
PTNCS

>  <AMOUNT_CURRENT> (912)
32.5

$$$$
WAY-335047
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    3.1042   -0.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2208    1.0083    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  2  0  0  0  0
  7  3  1  0  0  0  0
  8  6  1  0  0  0  0
  9  7  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14  9  2  0  0  0  0
 15 18  1  0  0  0  0
 16  6  1  0  0  0  0
 17  9  1  0  0  0  0
 18 13  2  0  0  0  0
 19 15  1  0  0  0  0
 11 10  1  0  0  0  0
 15  8  2  0  0  0  0
M  END
>  <Mol_ID> (913)
913

>  <Formula> (913)
C12H12ClFN2O3

>  <MolWeight> (913)
286.6866832

>  <PCAT_CMPD_ID> (913)
WAY-335047

>  <CNC_ID> (913)
359333576

>  <transfer_container_id> (913)
PTN000000067

>  <COMPOUND_NUMBER> (913)
WAY-335047

>  <BAR_CODE_NO> (913)
310048

>  <LOCATION_CODE> (913)
PTNCS

>  <AMOUNT_CURRENT> (913)
32.5

$$$$
WAY-348088
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    7.4375   -2.7167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 12  1  0  0  0  0
  8  3  1  0  0  0  0
  9  2  2  0  0  0  0
 10  7  1  0  0  0  0
 11  7  2  0  0  0  0
 12  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14 19  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 17  5  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 15  2  0  0  0  0
 21 15  1  0  0  0  0
 22  6  2  0  0  0  0
 23 17  1  0  0  0  0
 24 22  1  0  0  0  0
  6  5  1  0  0  0  0
 24 23  2  0  0  0  0
 18 14  2  0  0  0  0
M  END
>  <Mol_ID> (914)
914

>  <Formula> (914)
C17H14ClN3O2S

>  <MolWeight> (914)
359.82996

>  <PCAT_CMPD_ID> (914)
WAY-348088

>  <CNC_ID> (914)
359333721

>  <transfer_container_id> (914)
PTN000000067

>  <COMPOUND_NUMBER> (914)
WAY-348088

>  <BAR_CODE_NO> (914)
90459772

>  <LOCATION_CODE> (914)
PTNCS

>  <AMOUNT_CURRENT> (914)
32.5

$$$$
WAY-358437
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.4582    0.1103    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9203   -0.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3280    0.1103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7203   -0.5621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5444   -1.3276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4893    1.5241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6893    0.9897    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1996   -1.2621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 14  1  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (915)
915

>  <Formula> (915)
C18H18ClN3O2

>  <MolWeight> (915)
343.80742

>  <PCAT_CMPD_ID> (915)
WAY-358437

>  <CNC_ID> (915)
359333756

>  <transfer_container_id> (915)
PTN000000067

>  <COMPOUND_NUMBER> (915)
WAY-358437

>  <BAR_CODE_NO> (915)
90461738

>  <LOCATION_CODE> (915)
PTNCS

>  <AMOUNT_CURRENT> (915)
32.6

$$$$
WAY-389623
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 12  4  2  0  0  0  0
 13  6  1  0  0  0  0
 14 10  2  0  0  0  0
 15 11  1  0  0  0  0
 16 14  1  0  0  0  0
 17  5  1  0  0  0  0
  9  8  1  0  0  0  0
  3  6  2  0  0  0  0
 16 15  2  0  0  0  0
M  END
>  <Mol_ID> (916)
916

>  <Formula> (916)
C11H8N2OS3

>  <MolWeight> (916)
280.38902

>  <PCAT_CMPD_ID> (916)
WAY-389623

>  <CNC_ID> (916)
359333765

>  <transfer_container_id> (916)
PTN000000067

>  <COMPOUND_NUMBER> (916)
WAY-389623

>  <BAR_CODE_NO> (916)
90481104

>  <LOCATION_CODE> (916)
PTNCS

>  <AMOUNT_CURRENT> (916)
32.6

$$$$
WAY-625013
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
    1.2042    1.5000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 20  1  0  0  0  0
 13 14  2  0  0  0  0
 14  2  1  0  0  0  0
 15  5  1  0  0  0  0
 16  5  1  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
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 23 22  1  0  0  0  0
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 25 27  1  0  0  0  0
 26 21  1  0  0  0  0
 27 21  2  0  0  0  0
 28  4  1  0  0  0  0
 29  4  1  0  0  0  0
 30 12  1  0  0  0  0
 31 29  1  0  0  0  0
 32 28  1  0  0  0  0
 33 31  1  0  0  0  0
 33 32  1  0  0  0  0
  6  3  2  0  0  0  0
 19 12  1  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (917)
917

>  <Formula> (917)
C24H31ClN4O3S

>  <MolWeight> (917)
491.04594

>  <PCAT_CMPD_ID> (917)
WAY-625013

>  <CNC_ID> (917)
359333822

>  <transfer_container_id> (917)
PTN000000067

>  <COMPOUND_NUMBER> (917)
WAY-625013

>  <BAR_CODE_NO> (917)
90459194

>  <LOCATION_CODE> (917)
PTNCS

>  <AMOUNT_CURRENT> (917)
32.4

$$$$
WAY-625058
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10 19  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
 13  3  2  0  0  0  0
 14  7  1  0  0  0  0
 15  6  1  0  0  0  0
 16  3  1  0  0  0  0
 17 16  2  0  0  0  0
 18  6  2  0  0  0  0
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 27 10  1  0  0  0  0
 28  7  1  0  0  0  0
 29 22  1  0  0  0  0
 10 20  1  0  0  0  0
  5  4  2  0  0  0  0
 22 26  2  0  0  0  0
M  END
>  <Mol_ID> (918)
918

>  <Formula> (918)
C20H27N5O3S

>  <MolWeight> (918)
417.52508

>  <PCAT_CMPD_ID> (918)
WAY-625058

>  <CNC_ID> (918)
359333867

>  <transfer_container_id> (918)
PTN000000067

>  <COMPOUND_NUMBER> (918)
WAY-625058

>  <BAR_CODE_NO> (918)
90459240

>  <LOCATION_CODE> (918)
PTNCS

>  <AMOUNT_CURRENT> (918)
32.3

$$$$
WAY-625076
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  3  1  0  0  0  0
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 13  8  2  0  0  0  0
 14 12  1  0  0  0  0
 15  7  2  0  0  0  0
 16  9  2  0  0  0  0
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 21  8  1  0  0  0  0
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 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (919)
919

>  <Formula> (919)
C19H20N2O4

>  <MolWeight> (919)
340.3731

>  <PCAT_CMPD_ID> (919)
WAY-625076

>  <CNC_ID> (919)
359333885

>  <transfer_container_id> (919)
PTN000000067

>  <COMPOUND_NUMBER> (919)
WAY-625076

>  <BAR_CODE_NO> (919)
90459258

>  <LOCATION_CODE> (919)
PTNCS

>  <AMOUNT_CURRENT> (919)
32.2

$$$$
WAY-625096
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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  2  8  1  0  0  0  0
  3 10  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
  7 11  1  0  0  0  0
  8 13  1  0  0  0  0
  9  4  2  0  0  0  0
 10 15  1  0  0  0  0
 11  3  2  0  0  0  0
 12  5  1  0  0  0  0
 13  1  1  0  0  0  0
 14 12  1  0  0  0  0
 15 16  1  0  0  0  0
 16  6  1  0  0  0  0
 17  5  2  0  0  0  0
 18 12  2  0  0  0  0
 19  8  2  0  0  0  0
 20  6  2  0  0  0  0
 21 10  2  0  0  0  0
 22 14  1  0  0  0  0
 23 18  1  0  0  0  0
 24  3  1  0  0  0  0
 25  4  1  0  0  0  0
 26  9  1  0  0  0  0
 27 11  1  0  0  0  0
 28 24  2  0  0  0  0
 29 25  2  0  0  0  0
 30 29  1  0  0  0  0
 31 28  1  0  0  0  0
  2  9  1  0  0  0  0
 30 26  2  0  0  0  0
 31 27  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (920)
920

>  <Formula> (920)
C22H17N3O6

>  <MolWeight> (920)
419.38688

>  <PCAT_CMPD_ID> (920)
WAY-625096

>  <CNC_ID> (920)
359333905

>  <transfer_container_id> (920)
PTN000000067

>  <COMPOUND_NUMBER> (920)
WAY-625096

>  <BAR_CODE_NO> (920)
90459278

>  <LOCATION_CODE> (920)
PTNCS

>  <AMOUNT_CURRENT> (920)
32.3

$$$$
WAY-625135
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -0.4875    2.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0833   -0.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2958   -1.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2958   -0.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5708   -1.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7833    0.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 11  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  2  0  0  0  0
  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7  1  2  0  0  0  0
  8  2  2  0  0  0  0
  9  3  1  0  0  0  0
 10  1  1  0  0  0  0
 11  9  1  0  0  0  0
 12  4  1  0  0  0  0
 13  5  1  0  0  0  0
 14  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16  9  2  0  0  0  0
 17 18  1  0  0  0  0
 18 13  2  0  0  0  0
 19 17  1  0  0  0  0
 20 19  1  0  0  0  0
 15 14  2  0  0  0  0
  4  6  1  0  0  0  0
 17 12  2  0  0  0  0
M  END
>  <Mol_ID> (921)
921

>  <Formula> (921)
C14H12N2O3S

>  <MolWeight> (921)
288.32168

>  <PCAT_CMPD_ID> (921)
WAY-625135

>  <CNC_ID> (921)
359333944

>  <transfer_container_id> (921)
PTN000000067

>  <COMPOUND_NUMBER> (921)
WAY-625135

>  <BAR_CODE_NO> (921)
90459317

>  <LOCATION_CODE> (921)
PTNCS

>  <AMOUNT_CURRENT> (921)
32.8

$$$$
WAY-625154
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
    0.8667   -0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5625   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1500   -1.7375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2833   -0.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9958   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9958    0.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  4  2  0  0  0  0
  8  3  1  0  0  0  0
  9  8  1  0  0  0  0
 10  5  1  0  0  0  0
 11  6  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  2  0  0  0  0
 14 13  1  0  0  0  0
  6  2  1  0  0  0  0
 11 14  2  0  0  0  0
M  END
>  <Mol_ID> (922)
922

>  <Formula> (922)
C10H9ClN2O

>  <MolWeight> (922)
208.64426

>  <PCAT_CMPD_ID> (922)
WAY-625154

>  <CNC_ID> (922)
359333963

>  <transfer_container_id> (922)
PTN000000067

>  <COMPOUND_NUMBER> (922)
WAY-625154

>  <BAR_CODE_NO> (922)
90459336

>  <LOCATION_CODE> (922)
PTNCS

>  <AMOUNT_CURRENT> (922)
32.8

$$$$
WAY-625264
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
   -0.2583    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1750    0.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4917    1.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6292    0.4083    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0417    1.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9750    1.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  8 19  1  0  0  0  0
  9  6  2  0  0  0  0
 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  2  2  0  0  0  0
 13  3  2  0  0  0  0
 14 23  1  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17  7  1  0  0  0  0
 18 16  1  0  0  0  0
 19 17  1  0  0  0  0
 20 10  1  0  0  0  0
 21 11  2  0  0  0  0
 22 14  1  0  0  0  0
 23 15  2  0  0  0  0
 24 21  1  0  0  0  0
 25 11  1  0  0  0  0
 26 20  1  0  0  0  0
 27 22  1  0  0  0  0
 28 21  1  0  0  0  0
 29 25  2  0  0  0  0
 30 29  1  0  0  0  0
  5  4  1  0  0  0  0
 14 10  2  0  0  0  0
 18  8  1  0  0  0  0
 26 27  1  0  0  0  0
 30 28  2  0  0  0  0
M  END
>  <Mol_ID> (923)
923

>  <Formula> (923)
C22H22FN3O4

>  <MolWeight> (923)
411.4261832

>  <PCAT_CMPD_ID> (923)
WAY-625264

>  <CNC_ID> (923)
359334073

>  <transfer_container_id> (923)
PTN000000067

>  <COMPOUND_NUMBER> (923)
WAY-625264

>  <BAR_CODE_NO> (923)
90459450

>  <LOCATION_CODE> (923)
PTNCS

>  <AMOUNT_CURRENT> (923)
32

$$$$
WAY-625321
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.0583    2.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8458    2.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3583    0.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 12  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  2  0  0  0  0
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  9  3  1  0  0  0  0
 10  4  2  0  0  0  0
 11  1  1  0  0  0  0
 12 18  1  0  0  0  0
 13  3  1  0  0  0  0
 14 11  1  0  0  0  0
 15  8  1  0  0  0  0
 16  8  2  0  0  0  0
 17  9  2  0  0  0  0
 18 21  2  0  0  0  0
 19 20  1  0  0  0  0
 20 15  2  0  0  0  0
 21 15  1  0  0  0  0
 22  9  1  0  0  0  0
 23  5  1  0  0  0  0
 24 10  1  0  0  0  0
 13 14  2  0  0  0  0
 12 19  2  0  0  0  0
  7 10  1  0  0  0  0
M  END
>  <Mol_ID> (924)
924

>  <Formula> (924)
C17H16N4O2S

>  <MolWeight> (924)
340.39954

>  <PCAT_CMPD_ID> (924)
WAY-625321

>  <CNC_ID> (924)
359334130

>  <transfer_container_id> (924)
PTN000000067

>  <COMPOUND_NUMBER> (924)
WAY-625321

>  <BAR_CODE_NO> (924)
90459508

>  <LOCATION_CODE> (924)
PTNCS

>  <AMOUNT_CURRENT> (924)
32.3

$$$$
WAY-625350
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    2.1875    0.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 12  5  1  0  0  0  0
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 23  9  1  0  0  0  0
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 15 14  1  0  0  0  0
M  END
>  <Mol_ID> (925)
925

>  <Formula> (925)
C22H26N2O5S

>  <MolWeight> (925)
430.51724

>  <PCAT_CMPD_ID> (925)
WAY-625350

>  <CNC_ID> (925)
359334159

>  <transfer_container_id> (925)
PTN000000067

>  <COMPOUND_NUMBER> (925)
WAY-625350

>  <BAR_CODE_NO> (925)
90459537

>  <LOCATION_CODE> (925)
PTNCS

>  <AMOUNT_CURRENT> (925)
32.5

$$$$
WAY-625370
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11  5  1  0  0  0  0
 12 11  2  0  0  0  0
 13  4  2  0  0  0  0
 14  2  1  0  0  0  0
 15 16  1  0  0  0  0
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 17 11  1  0  0  0  0
 18  2  1  0  0  0  0
 19  3  1  0  0  0  0
 20 22  1  0  0  0  0
 21 10  1  0  0  0  0
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 25 14  2  0  0  0  0
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 28 25  1  0  0  0  0
 29 27  1  0  0  0  0
 20  8  2  0  0  0  0
 29 28  2  0  0  0  0
 15 10  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (926)
926

>  <Formula> (926)
C23H22N2O3S

>  <MolWeight> (926)
406.49738

>  <PCAT_CMPD_ID> (926)
WAY-625370

>  <CNC_ID> (926)
359334179

>  <transfer_container_id> (926)
PTN000000067

>  <COMPOUND_NUMBER> (926)
WAY-625370

>  <BAR_CODE_NO> (926)
90459558

>  <LOCATION_CODE> (926)
PTNCS

>  <AMOUNT_CURRENT> (926)
32.7

$$$$
WAY-625371
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  9  1  0  0  0  0
 12  8  1  0  0  0  0
 13 16  1  0  0  0  0
 14 12  1  0  0  0  0
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 18 14  2  0  0  0  0
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 21  9  1  0  0  0  0
 22 21  1  0  0  0  0
  6  4  2  0  0  0  0
 20 22  1  0  0  0  0
 13 17  2  0  0  0  0
M  END
>  <Mol_ID> (927)
927

>  <Formula> (927)
C14H14ClN3O2S2

>  <MolWeight> (927)
355.86286

>  <PCAT_CMPD_ID> (927)
WAY-625371

>  <CNC_ID> (927)
359334180

>  <transfer_container_id> (927)
PTN000000067

>  <COMPOUND_NUMBER> (927)
WAY-625371

>  <BAR_CODE_NO> (927)
90459559

>  <LOCATION_CODE> (927)
PTNCS

>  <AMOUNT_CURRENT> (927)
32.5

$$$$
WAY-625379
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  9  8  1  0  0  0  0
 10  3  1  0  0  0  0
 11  9  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  4  1  0  0  0  0
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 16  5  1  0  0  0  0
 17  4  2  0  0  0  0
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 19  9  1  0  0  0  0
 20  6  2  0  0  0  0
 21  6  1  0  0  0  0
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 29 14  1  0  0  0  0
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 18 16  2  0  0  0  0
 23 15  2  0  0  0  0
M  END
>  <Mol_ID> (928)
928

>  <Formula> (928)
C18H15Cl2N3O4S2

>  <MolWeight> (928)
472.3654

>  <PCAT_CMPD_ID> (928)
WAY-625379

>  <CNC_ID> (928)
359334188

>  <transfer_container_id> (928)
PTN000000067

>  <COMPOUND_NUMBER> (928)
WAY-625379

>  <BAR_CODE_NO> (928)
90459567

>  <LOCATION_CODE> (928)
PTNCS

>  <AMOUNT_CURRENT> (928)
32.3

$$$$
WAY-625547
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
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 27  6  1  0  0  0  0
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 31  7  1  0  0  0  0
 26 28  1  0  0  0  0
 20  8  1  0  0  0  0
 10  2  1  0  0  0  0
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M  END
>  <Mol_ID> (929)
929

>  <Formula> (929)
C20H21ClN4O4S2

>  <MolWeight> (929)
480.98814

>  <PCAT_CMPD_ID> (929)
WAY-625547

>  <CNC_ID> (929)
359334356

>  <transfer_container_id> (929)
PTN000000067

>  <COMPOUND_NUMBER> (929)
WAY-625547

>  <BAR_CODE_NO> (929)
90459737

>  <LOCATION_CODE> (929)
PTNCS

>  <AMOUNT_CURRENT> (929)
32.8

$$$$
WAY-625790
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  7  2  0  0  0  0
 14  7  1  0  0  0  0
 15  9  2  0  0  0  0
 16 11  1  0  0  0  0
 17 15  1  0  0  0  0
 18  8  2  0  0  0  0
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M  END
>  <Mol_ID> (930)
930

>  <Formula> (930)
C17H18N4O2S2

>  <MolWeight> (930)
374.48042

>  <PCAT_CMPD_ID> (930)
WAY-625790

>  <CNC_ID> (930)
359334599

>  <transfer_container_id> (930)
PTN000000067

>  <COMPOUND_NUMBER> (930)
WAY-625790

>  <BAR_CODE_NO> (930)
90459984

>  <LOCATION_CODE> (930)
PTNCS

>  <AMOUNT_CURRENT> (930)
32.3

$$$$
WAY-625915
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 14  1  0  0  0  0
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 15  9  1  0  0  0  0
 16  3  1  0  0  0  0
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 13 12  2  0  0  0  0
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 30 29  1  0  0  0  0
M  END
>  <Mol_ID> (931)
931

>  <Formula> (931)
C21H15F3N4OS

>  <MolWeight> (931)
428.4302096

>  <PCAT_CMPD_ID> (931)
WAY-625915

>  <CNC_ID> (931)
359334724

>  <transfer_container_id> (931)
PTN000000067

>  <COMPOUND_NUMBER> (931)
WAY-625915

>  <BAR_CODE_NO> (931)
90460109

>  <LOCATION_CODE> (931)
PTNCS

>  <AMOUNT_CURRENT> (931)
32.7

$$$$
WAY-625929
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16  9  2  0  0  0  0
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 17 18  2  0  0  0  0
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (932)
932

>  <Formula> (932)
C14H13N3O2S3

>  <MolWeight> (932)
351.46692

>  <PCAT_CMPD_ID> (932)
WAY-625929

>  <CNC_ID> (932)
359334738

>  <transfer_container_id> (932)
PTN000000067

>  <COMPOUND_NUMBER> (932)
WAY-625929

>  <BAR_CODE_NO> (932)
90460123

>  <LOCATION_CODE> (932)
PTNCS

>  <AMOUNT_CURRENT> (932)
33

$$$$
WAY-625935
csChFnd80/10111816222D

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 20 12  2  0  0  0  0
 21  2  1  0  0  0  0
 22  3  1  0  0  0  0
 23 18  1  0  0  0  0
 24 18  2  0  0  0  0
 25 26  2  0  0  0  0
 26 24  1  0  0  0  0
 27 23  2  0  0  0  0
 28 25  1  0  0  0  0
 29 21  1  0  0  0  0
 30 29  1  0  0  0  0
  7 10  2  0  0  0  0
  5  2  1  0  0  0  0
 15 14  1  0  0  0  0
 25 27  1  0  0  0  0
M  END
>  <Mol_ID> (933)
933

>  <Formula> (933)
C21H21FN4O3S

>  <MolWeight> (933)
428.4798432

>  <PCAT_CMPD_ID> (933)
WAY-625935

>  <CNC_ID> (933)
359334744

>  <transfer_container_id> (933)
PTN000000067

>  <COMPOUND_NUMBER> (933)
WAY-625935

>  <BAR_CODE_NO> (933)
90460129

>  <LOCATION_CODE> (933)
PTNCS

>  <AMOUNT_CURRENT> (933)
32.9

$$$$
WAY-625944
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11 12  1  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14  5  1  0  0  0  0
 15 13  1  0  0  0  0
 16  8  1  0  0  0  0
 17 16  2  0  0  0  0
 18 17  1  0  0  0  0
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 20 15  2  0  0  0  0
 21 14  1  0  0  0  0
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 23 20  1  0  0  0  0
 24 19  2  0  0  0  0
 25 23  2  0  0  0  0
  4  5  1  0  0  0  0
 18 12  2  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (934)
934

>  <Formula> (934)
C18H19N5O2

>  <MolWeight> (934)
337.37576

>  <PCAT_CMPD_ID> (934)
WAY-625944

>  <CNC_ID> (934)
359334753

>  <transfer_container_id> (934)
PTN000000067

>  <COMPOUND_NUMBER> (934)
WAY-625944

>  <BAR_CODE_NO> (934)
90460138

>  <LOCATION_CODE> (934)
PTNCS

>  <AMOUNT_CURRENT> (934)
32.8

$$$$
WAY-625977
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  9  2  0  0  0  0
 13  5  2  0  0  0  0
 14 12  1  0  0  0  0
 15  4  2  0  0  0  0
 16  7  1  0  0  0  0
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 18  5  1  0  0  0  0
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 20 21  1  0  0  0  0
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 20 17  2  0  0  0  0
 29 30  1  0  0  0  0
 22 14  2  0  0  0  0
M  END
>  <Mol_ID> (935)
935

>  <Formula> (935)
C21H18BrFN2O4S

>  <MolWeight> (935)
493.3460232

>  <PCAT_CMPD_ID> (935)
WAY-625977

>  <CNC_ID> (935)
359334786

>  <transfer_container_id> (935)
PTN000000067

>  <COMPOUND_NUMBER> (935)
WAY-625977

>  <BAR_CODE_NO> (935)
90460171

>  <LOCATION_CODE> (935)
PTNCS

>  <AMOUNT_CURRENT> (935)
32.2

$$$$
WAY-625980
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11 17  1  0  0  0  0
 12  4  2  0  0  0  0
 13  9  2  0  0  0  0
 14  2  1  0  0  0  0
 15  3  1  0  0  0  0
 16  3  2  0  0  0  0
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 18 14  1  0  0  0  0
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 15 20  2  0  0  0  0
 21  9  1  0  0  0  0
 17 20  1  0  0  0  0
  4  8  1  0  0  0  0
M  END
>  <Mol_ID> (936)
936

>  <Formula> (936)
C13H17N3O4S

>  <MolWeight> (936)
311.35678

>  <PCAT_CMPD_ID> (936)
WAY-625980

>  <CNC_ID> (936)
359334789

>  <transfer_container_id> (936)
PTN000000067

>  <COMPOUND_NUMBER> (936)
WAY-625980

>  <BAR_CODE_NO> (936)
90460174

>  <LOCATION_CODE> (936)
PTNCS

>  <AMOUNT_CURRENT> (936)
32.2

$$$$
WAY-625988
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (937)
937

>  <Formula> (937)
C10H7N3O2S2

>  <MolWeight> (937)
265.31148

>  <PCAT_CMPD_ID> (937)
WAY-625988

>  <CNC_ID> (937)
359334797

>  <transfer_container_id> (937)
PTN000000067

>  <COMPOUND_NUMBER> (937)
WAY-625988

>  <BAR_CODE_NO> (937)
90460182

>  <LOCATION_CODE> (937)
PTNCS

>  <AMOUNT_CURRENT> (937)
33

$$$$
WAY-626249
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 14  1  2  0  0  0  0
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M  END
>  <Mol_ID> (938)
938

>  <Formula> (938)
C18H17ClN4O3S

>  <MolWeight> (938)
404.87058

>  <PCAT_CMPD_ID> (938)
WAY-626249

>  <CNC_ID> (938)
359335058

>  <transfer_container_id> (938)
PTN000000067

>  <COMPOUND_NUMBER> (938)
WAY-626249

>  <BAR_CODE_NO> (938)
90460444

>  <LOCATION_CODE> (938)
PTNCS

>  <AMOUNT_CURRENT> (938)
32.5

$$$$
WAY-626306
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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 23  4  1  0  0  0  0
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 10  9  1  0  0  0  0
 21 20  2  0  0  0  0
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 31 30  1  0  0  0  0
M  END
>  <Mol_ID> (939)
939

>  <Formula> (939)
C23H25N5O3

>  <MolWeight> (939)
419.4763

>  <PCAT_CMPD_ID> (939)
WAY-626306

>  <CNC_ID> (939)
359335114

>  <transfer_container_id> (939)
PTN000000067

>  <COMPOUND_NUMBER> (939)
WAY-626306

>  <BAR_CODE_NO> (939)
90460502

>  <LOCATION_CODE> (939)
PTNCS

>  <AMOUNT_CURRENT> (939)
32.3

$$$$
WAY-626394
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
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 13  5  2  0  0  0  0
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 17  8  2  0  0  0  0
M  END
>  <Mol_ID> (940)
940

>  <Formula> (940)
C21H21N3O5

>  <MolWeight> (940)
395.40854

>  <PCAT_CMPD_ID> (940)
WAY-626394

>  <CNC_ID> (940)
359335201

>  <transfer_container_id> (940)
PTN000000067

>  <COMPOUND_NUMBER> (940)
WAY-626394

>  <BAR_CODE_NO> (940)
90460592

>  <LOCATION_CODE> (940)
PTNCS

>  <AMOUNT_CURRENT> (940)
32.1

$$$$
WAY-626403
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 14  7  1  0  0  0  0
 25 30  2  0  0  0  0
M  END
>  <Mol_ID> (941)
941

>  <Formula> (941)
C24H24N4O5S

>  <MolWeight> (941)
480.53616

>  <PCAT_CMPD_ID> (941)
WAY-626403

>  <CNC_ID> (941)
359335210

>  <transfer_container_id> (941)
PTN000000067

>  <COMPOUND_NUMBER> (941)
WAY-626403

>  <BAR_CODE_NO> (941)
90460601

>  <LOCATION_CODE> (941)
PTNCS

>  <AMOUNT_CURRENT> (941)
32.3

$$$$
WAY-626478
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 12  8  1  0  0  0  0
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M  END
>  <Mol_ID> (942)
942

>  <Formula> (942)
C14H13BrN2O4

>  <MolWeight> (942)
353.16802

>  <PCAT_CMPD_ID> (942)
WAY-626478

>  <CNC_ID> (942)
359335285

>  <transfer_container_id> (942)
PTN000000067

>  <COMPOUND_NUMBER> (942)
WAY-626478

>  <BAR_CODE_NO> (942)
90460683

>  <LOCATION_CODE> (942)
PTNCS

>  <AMOUNT_CURRENT> (942)
32.7

$$$$
WAY-626577
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  7 10  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  4  1  0  0  0  0
 12  5  2  0  0  0  0
 13  4  2  0  0  0  0
 14  7  2  0  0  0  0
 15  6  1  0  0  0  0
 16  1  1  0  0  0  0
 17  5  1  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 12  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 19 12  1  0  0  0  0
 22 20  2  0  0  0  0
  9  6  2  0  0  0  0
M  END
>  <Mol_ID> (943)
943

>  <Formula> (943)
C16H14BrNO4

>  <MolWeight> (943)
364.19066

>  <PCAT_CMPD_ID> (943)
WAY-626577

>  <CNC_ID> (943)
359335384

>  <transfer_container_id> (943)
PTN000000067

>  <COMPOUND_NUMBER> (943)
WAY-626577

>  <BAR_CODE_NO> (943)
90460784

>  <LOCATION_CODE> (943)
PTNCS

>  <AMOUNT_CURRENT> (943)
32.6

$$$$
WAY-626648
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  6 10  1  0  0  0  0
  7  6  2  0  0  0  0
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 10 13  1  0  0  0  0
 11  7  1  0  0  0  0
 12  8  2  0  0  0  0
 13 18  1  0  0  0  0
 14  1  1  0  0  0  0
 15  9  1  0  0  0  0
 16  9  2  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19  4  1  0  0  0  0
 20  5  1  0  0  0  0
 21 12  1  0  0  0  0
 22 14  1  0  0  0  0
 23 14  2  0  0  0  0
 24 23  1  0  0  0  0
 25 22  2  0  0  0  0
 26 24  2  0  0  0  0
  5  2  1  0  0  0  0
 26 25  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (944)
944

>  <Formula> (944)
C18H18N4O4

>  <MolWeight> (944)
354.35992

>  <PCAT_CMPD_ID> (944)
WAY-626648

>  <CNC_ID> (944)
359335455

>  <transfer_container_id> (944)
PTN000000067

>  <COMPOUND_NUMBER> (944)
WAY-626648

>  <BAR_CODE_NO> (944)
90460855

>  <LOCATION_CODE> (944)
PTNCS

>  <AMOUNT_CURRENT> (944)
32.8

$$$$
WAY-626702
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  4  2  2  0  0  0  0
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  7 14  1  0  0  0  0
  8  5  1  0  0  0  0
  9 16  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14 17  2  0  0  0  0
 15  8  2  0  0  0  0
 16 19  2  0  0  0  0
 17 18  1  0  0  0  0
 18 13  1  0  0  0  0
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 20  2  1  0  0  0  0
 21  4  1  0  0  0  0
 22  3  1  0  0  0  0
 23 20  2  0  0  0  0
 24 23  1  0  0  0  0
  4  6  1  0  0  0  0
 24 21  2  0  0  0  0
  9  7  2  0  0  0  0
 12 11  1  0  0  0  0
M  END
>  <Mol_ID> (945)
945

>  <Formula> (945)
C19H20N2O3

>  <MolWeight> (945)
324.3737

>  <PCAT_CMPD_ID> (945)
WAY-626702

>  <CNC_ID> (945)
359335508

>  <transfer_container_id> (945)
PTN000000067

>  <COMPOUND_NUMBER> (945)
WAY-626702

>  <BAR_CODE_NO> (945)
90460910

>  <LOCATION_CODE> (945)
PTNCS

>  <AMOUNT_CURRENT> (945)
32.1

$$$$
WAY-626713
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  3  1  0  0  0  0
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 13 12  1  0  0  0  0
 14  1  1  0  0  0  0
 15 14  3  0  0  0  0
 16  4  1  0  0  0  0
 17  9  1  0  0  0  0
 18 10  1  0  0  0  0
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  8 10  2  0  0  0  0
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 13 11  1  0  0  0  0
 28 27  1  0  0  0  0
M  END
>  <Mol_ID> (946)
946

>  <Formula> (946)
C21H22N6O

>  <MolWeight> (946)
374.43898

>  <PCAT_CMPD_ID> (946)
WAY-626713

>  <CNC_ID> (946)
359335519

>  <transfer_container_id> (946)
PTN000000067

>  <COMPOUND_NUMBER> (946)
WAY-626713

>  <BAR_CODE_NO> (946)
90460922

>  <LOCATION_CODE> (946)
PTNCS

>  <AMOUNT_CURRENT> (946)
32.6

$$$$
WAY-626717
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  4  2  0  0  0  0
 12  5  2  0  0  0  0
 13 10  1  0  0  0  0
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 16  8  1  0  0  0  0
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 20  9  1  0  0  0  0
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 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (947)
947

>  <Formula> (947)
C14H11FN2OS2

>  <MolWeight> (947)
306.3783432

>  <PCAT_CMPD_ID> (947)
WAY-626717

>  <CNC_ID> (947)
359335523

>  <transfer_container_id> (947)
PTN000000067

>  <COMPOUND_NUMBER> (947)
WAY-626717

>  <BAR_CODE_NO> (947)
90460926

>  <LOCATION_CODE> (947)
PTNCS

>  <AMOUNT_CURRENT> (947)
32.6

$$$$
WAY-626736
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 14  6  2  0  0  0  0
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 20  9  1  0  0  0  0
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 27 22  2  0  0  0  0
 12  5  1  0  0  0  0
 29 23  2  0  0  0  0
M  END
>  <Mol_ID> (948)
948

>  <Formula> (948)
C23H27N3O2S

>  <MolWeight> (948)
409.54438

>  <PCAT_CMPD_ID> (948)
WAY-626736

>  <CNC_ID> (948)
359335542

>  <transfer_container_id> (948)
PTN000000067

>  <COMPOUND_NUMBER> (948)
WAY-626736

>  <BAR_CODE_NO> (948)
90460945

>  <LOCATION_CODE> (948)
PTNCS

>  <AMOUNT_CURRENT> (948)
32.1

$$$$
WAY-626837
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  1  1  0  0  0  0
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 14  4  1  0  0  0  0
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 29 27  1  0  0  0  0
M  END
>  <Mol_ID> (949)
949

>  <Formula> (949)
C24H25N3OS

>  <MolWeight> (949)
403.5398

>  <PCAT_CMPD_ID> (949)
WAY-626837

>  <CNC_ID> (949)
359335642

>  <transfer_container_id> (949)
PTN000000067

>  <COMPOUND_NUMBER> (949)
WAY-626837

>  <BAR_CODE_NO> (949)
90461050

>  <LOCATION_CODE> (949)
PTNCS

>  <AMOUNT_CURRENT> (949)
32.5

$$$$
WAY-626848
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 27 23  2  0  0  0  0
M  END
>  <Mol_ID> (950)
950

>  <Formula> (950)
C23H24N4O3

>  <MolWeight> (950)
404.46166

>  <PCAT_CMPD_ID> (950)
WAY-626848

>  <CNC_ID> (950)
359335653

>  <transfer_container_id> (950)
PTN000000067

>  <COMPOUND_NUMBER> (950)
WAY-626848

>  <BAR_CODE_NO> (950)
90461062

>  <LOCATION_CODE> (950)
PTNCS

>  <AMOUNT_CURRENT> (950)
33

$$$$
WAY-627177
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
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M  END
>  <Mol_ID> (951)
951

>  <Formula> (951)
C18H17N3O3S

>  <MolWeight> (951)
355.41088

>  <PCAT_CMPD_ID> (951)
WAY-627177

>  <CNC_ID> (951)
359335981

>  <transfer_container_id> (951)
PTN000000067

>  <COMPOUND_NUMBER> (951)
WAY-627177

>  <BAR_CODE_NO> (951)
90461394

>  <LOCATION_CODE> (951)
PTNCS

>  <AMOUNT_CURRENT> (951)
32.3

$$$$
WAY-627209
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (952)
952

>  <Formula> (952)
C22H25N5O5S

>  <MolWeight> (952)
471.5294

>  <PCAT_CMPD_ID> (952)
WAY-627209

>  <CNC_ID> (952)
359336013

>  <transfer_container_id> (952)
PTN000000067

>  <COMPOUND_NUMBER> (952)
WAY-627209

>  <BAR_CODE_NO> (952)
90461426

>  <LOCATION_CODE> (952)
PTNCS

>  <AMOUNT_CURRENT> (952)
32.2

$$$$
WAY-627576
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 13  3  2  0  0  0  0
 14  4  2  0  0  0  0
 15  5  2  0  0  0  0
 16  7  2  0  0  0  0
 17  9  1  0  0  0  0
 18 16  1  0  0  0  0
 19  6  1  0  0  0  0
 20  6  1  0  0  0  0
 21  8  1  0  0  0  0
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 23  5  1  0  0  0  0
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 17 18  2  0  0  0  0
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M  END
>  <Mol_ID> (953)
953

>  <Formula> (953)
C18H22N4O4

>  <MolWeight> (953)
358.39168

>  <PCAT_CMPD_ID> (953)
WAY-627576

>  <CNC_ID> (953)
359336380

>  <transfer_container_id> (953)
PTN000000067

>  <COMPOUND_NUMBER> (953)
WAY-627576

>  <BAR_CODE_NO> (953)
90461807

>  <LOCATION_CODE> (953)
PTNCS

>  <AMOUNT_CURRENT> (953)
32.6

$$$$
WAY-627583
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (954)
954

>  <Formula> (954)
C24H26N2O6S

>  <MolWeight> (954)
470.53804

>  <PCAT_CMPD_ID> (954)
WAY-627583

>  <CNC_ID> (954)
359336387

>  <transfer_container_id> (954)
PTN000000067

>  <COMPOUND_NUMBER> (954)
WAY-627583

>  <BAR_CODE_NO> (954)
90461815

>  <LOCATION_CODE> (954)
PTNCS

>  <AMOUNT_CURRENT> (954)
33

$$$$
WAY-627237
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 15  7  1  0  0  0  0
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M  END
>  <Mol_ID> (955)
955

>  <Formula> (955)
C18H17N3O4S

>  <MolWeight> (955)
371.41028

>  <PCAT_CMPD_ID> (955)
WAY-627237

>  <CNC_ID> (955)
359336041

>  <transfer_container_id> (955)
PTN000000067

>  <COMPOUND_NUMBER> (955)
WAY-627237

>  <BAR_CODE_NO> (955)
90461455

>  <LOCATION_CODE> (955)
PTNCS

>  <AMOUNT_CURRENT> (955)
32.6

$$$$
WAY-627253
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (956)
956

>  <Formula> (956)
C19H17N5OS2

>  <MolWeight> (956)
395.50118

>  <PCAT_CMPD_ID> (956)
WAY-627253

>  <CNC_ID> (956)
359336057

>  <transfer_container_id> (956)
PTN000000067

>  <COMPOUND_NUMBER> (956)
WAY-627253

>  <BAR_CODE_NO> (956)
90461471

>  <LOCATION_CODE> (956)
PTNCS

>  <AMOUNT_CURRENT> (956)
32.2

$$$$
WAY-627263
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  2  0  0  0  0
 14  8  2  0  0  0  0
 15 23  1  0  0  0  0
 16  6  1  0  0  0  0
 17 12  1  0  0  0  0
 18  3  1  0  0  0  0
 19  3  1  0  0  0  0
 20 12  1  0  0  0  0
 21 13  1  0  0  0  0
 22  6  1  0  0  0  0
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 25  9  1  0  0  0  0
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 29 28  1  0  0  0  0
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 20 16  2  0  0  0  0
 29 26  2  0  0  0  0
M  END
>  <Mol_ID> (957)
957

>  <Formula> (957)
C20H23ClN2O5S

>  <MolWeight> (957)
438.92502

>  <PCAT_CMPD_ID> (957)
WAY-627263

>  <CNC_ID> (957)
359336067

>  <transfer_container_id> (957)
PTN000000067

>  <COMPOUND_NUMBER> (957)
WAY-627263

>  <BAR_CODE_NO> (957)
90461481

>  <LOCATION_CODE> (957)
PTNCS

>  <AMOUNT_CURRENT> (957)
32.5

$$$$
WAY-627267
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 15  5  2  0  0  0  0
 16  7  2  0  0  0  0
 17  8  2  0  0  0  0
 18 13  1  0  0  0  0
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 21  3  1  0  0  0  0
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 25 24  1  0  0  0  0
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 25 22  2  0  0  0  0
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M  END
>  <Mol_ID> (958)
958

>  <Formula> (958)
C17H19N3O5

>  <MolWeight> (958)
345.34986

>  <PCAT_CMPD_ID> (958)
WAY-627267

>  <CNC_ID> (958)
359336071

>  <transfer_container_id> (958)
PTN000000067

>  <COMPOUND_NUMBER> (958)
WAY-627267

>  <BAR_CODE_NO> (958)
90461485

>  <LOCATION_CODE> (958)
PTNCS

>  <AMOUNT_CURRENT> (958)
32.9

$$$$
WAY-627288
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
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M  END
>  <Mol_ID> (959)
959

>  <Formula> (959)
C22H23N5O4

>  <MolWeight> (959)
421.44912

>  <PCAT_CMPD_ID> (959)
WAY-627288

>  <CNC_ID> (959)
359336092

>  <transfer_container_id> (959)
PTN000000067

>  <COMPOUND_NUMBER> (959)
WAY-627288

>  <BAR_CODE_NO> (959)
90461507

>  <LOCATION_CODE> (959)
PTNCS

>  <AMOUNT_CURRENT> (959)
32.5

$$$$
WAY-627299
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 23 21  2  0  0  0  0
 12 14  2  0  0  0  0
M  END
>  <Mol_ID> (960)
960

>  <Formula> (960)
C19H15NO2S

>  <MolWeight> (960)
321.3929

>  <PCAT_CMPD_ID> (960)
WAY-627299

>  <CNC_ID> (960)
359336103

>  <transfer_container_id> (960)
PTN000000067

>  <COMPOUND_NUMBER> (960)
WAY-627299

>  <BAR_CODE_NO> (960)
90461518

>  <LOCATION_CODE> (960)
PTNCS

>  <AMOUNT_CURRENT> (960)
32.5

$$$$
WAY-644875
csChFnd80/10111816222D

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 22  7  1  0  0  0  0
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 13 20  2  0  0  0  0
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  3 14  2  0  0  0  0
M  END
>  <Mol_ID> (961)
961

>  <Formula> (961)
C16H15N3O4S

>  <MolWeight> (961)
345.373

>  <PCAT_CMPD_ID> (961)
WAY-644875

>  <CNC_ID> (961)
359337547

>  <transfer_container_id> (961)
PTN000000067

>  <COMPOUND_NUMBER> (961)
WAY-644875

>  <BAR_CODE_NO> (961)
90479458

>  <LOCATION_CODE> (961)
PTNCS

>  <AMOUNT_CURRENT> (961)
32.9

$$$$
WAY-644912
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (962)
962

>  <Formula> (962)
C18H25N5O4S3

>  <MolWeight> (962)
471.6172

>  <PCAT_CMPD_ID> (962)
WAY-644912

>  <CNC_ID> (962)
359337584

>  <transfer_container_id> (962)
PTN000000067

>  <COMPOUND_NUMBER> (962)
WAY-644912

>  <BAR_CODE_NO> (962)
90479495

>  <LOCATION_CODE> (962)
PTNCS

>  <AMOUNT_CURRENT> (962)
32.5

$$$$
WAY-644980
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (963)
963

>  <Formula> (963)
C23H23N3O4S2

>  <MolWeight> (963)
469.57642

>  <PCAT_CMPD_ID> (963)
WAY-644980

>  <CNC_ID> (963)
359337652

>  <transfer_container_id> (963)
PTN000000067

>  <COMPOUND_NUMBER> (963)
WAY-644980

>  <BAR_CODE_NO> (963)
90479565

>  <LOCATION_CODE> (963)
PTNCS

>  <AMOUNT_CURRENT> (963)
32.7

$$$$
WAY-645010
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (964)
964

>  <Formula> (964)
C11H13N5

>  <MolWeight> (964)
215.25442

>  <PCAT_CMPD_ID> (964)
WAY-645010

>  <CNC_ID> (964)
359337682

>  <transfer_container_id> (964)
PTN000000067

>  <COMPOUND_NUMBER> (964)
WAY-645010

>  <BAR_CODE_NO> (964)
90479595

>  <LOCATION_CODE> (964)
PTNCS

>  <AMOUNT_CURRENT> (964)
32.8

$$$$
WAY-645016
csChFnd80/10111816222D

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 10  8  2  0  0  0  0
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 31 30  2  0  0  0  0
M  END
>  <Mol_ID> (965)
965

>  <Formula> (965)
C21H24N6O2S2

>  <MolWeight> (965)
456.58426

>  <PCAT_CMPD_ID> (965)
WAY-645016

>  <CNC_ID> (965)
359337688

>  <transfer_container_id> (965)
PTN000000067

>  <COMPOUND_NUMBER> (965)
WAY-645016

>  <BAR_CODE_NO> (965)
90479601

>  <LOCATION_CODE> (965)
PTNCS

>  <AMOUNT_CURRENT> (965)
32.9

$$$$
WAY-645170
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
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 19  5  1  0  0  0  0
 20  5  1  0  0  0  0
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 13  9  1  0  0  0  0
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M  END
>  <Mol_ID> (966)
966

>  <Formula> (966)
C20H14F3N3O3

>  <MolWeight> (966)
401.3386696

>  <PCAT_CMPD_ID> (966)
WAY-645170

>  <CNC_ID> (966)
359337842

>  <transfer_container_id> (966)
PTN000000067

>  <COMPOUND_NUMBER> (966)
WAY-645170

>  <BAR_CODE_NO> (966)
90479757

>  <LOCATION_CODE> (966)
PTNCS

>  <AMOUNT_CURRENT> (966)
32.3

$$$$
WAY-645492
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 16  9  1  0  0  0  0
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 13 14  2  0  0  0  0
 23 22  2  0  0  0  0
 11  8  2  0  0  0  0
M  END
>  <Mol_ID> (967)
967

>  <Formula> (967)
C15H10N6O2

>  <MolWeight> (967)
306.2789

>  <PCAT_CMPD_ID> (967)
WAY-645492

>  <CNC_ID> (967)
359338164

>  <transfer_container_id> (967)
PTN000000067

>  <COMPOUND_NUMBER> (967)
WAY-645492

>  <BAR_CODE_NO> (967)
90480083

>  <LOCATION_CODE> (967)
PTNCS

>  <AMOUNT_CURRENT> (967)
33

$$$$
WAY-645511
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 12  9  2  0  0  0  0
 13  3  1  0  0  0  0
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 17  5  1  0  0  0  0
 18  7  1  0  0  0  0
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 20  9  1  0  0  0  0
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 10 12  1  0  0  0  0
 26 21  2  0  0  0  0
M  END
>  <Mol_ID> (968)
968

>  <Formula> (968)
C20H18N4O3

>  <MolWeight> (968)
362.38192

>  <PCAT_CMPD_ID> (968)
WAY-645511

>  <CNC_ID> (968)
359338183

>  <transfer_container_id> (968)
PTN000000067

>  <COMPOUND_NUMBER> (968)
WAY-645511

>  <BAR_CODE_NO> (968)
90480103

>  <LOCATION_CODE> (968)
PTNCS

>  <AMOUNT_CURRENT> (968)
32.1

$$$$
WAY-645586
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  3  6  2  0  0  0  0
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 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (969)
969

>  <Formula> (969)
C20H25N3O4

>  <MolWeight> (969)
371.4302

>  <PCAT_CMPD_ID> (969)
WAY-645586

>  <CNC_ID> (969)
359338258

>  <transfer_container_id> (969)
PTN000000067

>  <COMPOUND_NUMBER> (969)
WAY-645586

>  <BAR_CODE_NO> (969)
90480179

>  <LOCATION_CODE> (969)
PTNCS

>  <AMOUNT_CURRENT> (969)
32.6

$$$$
WAY-645595
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  1  2  0  0  0  0
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 13  2  1  0  0  0  0
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 20  6  2  0  0  0  0
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 22  8  2  0  0  0  0
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 28  9  1  0  0  0  0
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 31 15  2  0  0  0  0
 23 25  1  0  0  0  0
 16  4  1  0  0  0  0
 27  7  1  0  0  0  0
 14  9  1  0  0  0  0
M  END
>  <Mol_ID> (970)
970

>  <Formula> (970)
C22H25FN2O5S

>  <MolWeight> (970)
448.5077032

>  <PCAT_CMPD_ID> (970)
WAY-645595

>  <CNC_ID> (970)
359338267

>  <transfer_container_id> (970)
PTN000000067

>  <COMPOUND_NUMBER> (970)
WAY-645595

>  <BAR_CODE_NO> (970)
90480188

>  <LOCATION_CODE> (970)
PTNCS

>  <AMOUNT_CURRENT> (970)
32.1

$$$$
WAY-645655
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  3  2  0  0  0  0
 12  1  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  2  0  0  0  0
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 16 10  1  0  0  0  0
 17  9  1  0  0  0  0
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M  END
>  <Mol_ID> (971)
971

>  <Formula> (971)
C19H16FN5O3

>  <MolWeight> (971)
381.3604432

>  <PCAT_CMPD_ID> (971)
WAY-645655

>  <CNC_ID> (971)
359338327

>  <transfer_container_id> (971)
PTN000000067

>  <COMPOUND_NUMBER> (971)
WAY-645655

>  <BAR_CODE_NO> (971)
90480248

>  <LOCATION_CODE> (971)
PTNCS

>  <AMOUNT_CURRENT> (971)
32.8

$$$$
WAY-645673
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
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 15  5  1  0  0  0  0
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 18 16  2  0  0  0  0
  5  6  2  0  0  0  0
 10  9  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (972)
972

>  <Formula> (972)
C12H9N3O2S

>  <MolWeight> (972)
259.28376

>  <PCAT_CMPD_ID> (972)
WAY-645673

>  <CNC_ID> (972)
359338345

>  <transfer_container_id> (972)
PTN000000067

>  <COMPOUND_NUMBER> (972)
WAY-645673

>  <BAR_CODE_NO> (972)
90480267

>  <LOCATION_CODE> (972)
PTNCS

>  <AMOUNT_CURRENT> (972)
32.4

$$$$
WAY-645731
csChFnd80/10111816222D

 27 31  0  0  0  0  0  0  0  0999 V2000
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 14  2  1  0  0  0  0
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M  END
>  <Mol_ID> (973)
973

>  <Formula> (973)
C23H27N3O

>  <MolWeight> (973)
361.47998

>  <PCAT_CMPD_ID> (973)
WAY-645731

>  <CNC_ID> (973)
359338403

>  <transfer_container_id> (973)
PTN000000067

>  <COMPOUND_NUMBER> (973)
WAY-645731

>  <BAR_CODE_NO> (973)
90480325

>  <LOCATION_CODE> (973)
PTNCS

>  <AMOUNT_CURRENT> (973)
32

$$$$
WAY-645852
csChFnd80/10111816222D

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 10  1  1  0  0  0  0
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 11  2  2  0  0  0  0
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 16 14  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (974)
974

>  <Formula> (974)
C17H16N4O2S

>  <MolWeight> (974)
340.39954

>  <PCAT_CMPD_ID> (974)
WAY-645852

>  <CNC_ID> (974)
359338524

>  <transfer_container_id> (974)
PTN000000067

>  <COMPOUND_NUMBER> (974)
WAY-645852

>  <BAR_CODE_NO> (974)
90480448

>  <LOCATION_CODE> (974)
PTNCS

>  <AMOUNT_CURRENT> (974)
32.5

$$$$
WAY-645918
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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 14  1  1  0  0  0  0
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 22  6  1  0  0  0  0
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 25 28  1  0  0  0  0
 26 14  1  0  0  0  0
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 29 27  1  0  0  0  0
 30 26  2  0  0  0  0
 31 29  2  0  0  0  0
  3  8  1  0  0  0  0
 31 30  1  0  0  0  0
 18 20  2  0  0  0  0
  9 10  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (975)
975

>  <Formula> (975)
C22H18ClN5O2S

>  <MolWeight> (975)
451.92862

>  <PCAT_CMPD_ID> (975)
WAY-645918

>  <CNC_ID> (975)
359338591

>  <transfer_container_id> (975)
PTN000000067

>  <COMPOUND_NUMBER> (975)
WAY-645918

>  <BAR_CODE_NO> (975)
90480515

>  <LOCATION_CODE> (975)
PTNCS

>  <AMOUNT_CURRENT> (975)
33

$$$$
WAY-645926
csChFnd80/10111816222D

 27 28  0  0  0  0  0  0  0  0999 V2000
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 10 17  1  0  0  0  0
 11  7  2  0  0  0  0
 12  7  1  0  0  0  0
 13  5  1  0  0  0  0
 14  1  1  0  0  0  0
 15  4  2  0  0  0  0
 16  6  2  0  0  0  0
 17 19  1  0  0  0  0
 18  2  1  0  0  0  0
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 20 10  2  0  0  0  0
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 22  3  1  0  0  0  0
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  6  5  1  0  0  0  0
  9  8  1  0  0  0  0
M  END
>  <Mol_ID> (976)
976

>  <Formula> (976)
C17H22N4O6

>  <MolWeight> (976)
378.37978

>  <PCAT_CMPD_ID> (976)
WAY-645926

>  <CNC_ID> (976)
359338599

>  <transfer_container_id> (976)
PTN000000067

>  <COMPOUND_NUMBER> (976)
WAY-645926

>  <BAR_CODE_NO> (976)
90480523

>  <LOCATION_CODE> (976)
PTNCS

>  <AMOUNT_CURRENT> (976)
32.9

$$$$
WAY-646044
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  3  2  1  0  0  0  0
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  8  5  1  0  0  0  0
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 10  1  1  0  0  0  0
 11  6  1  0  0  0  0
 12  9  1  0  0  0  0
 13 19  1  0  0  0  0
 14  4  2  0  0  0  0
 15  7  2  0  0  0  0
 16 15  1  0  0  0  0
 17 10  2  0  0  0  0
 18 10  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23  6  1  0  0  0  0
  8  3  2  0  0  0  0
 20 21  2  0  0  0  0
 12 16  2  0  0  0  0
M  END
>  <Mol_ID> (977)
977

>  <Formula> (977)
C16H15N3O3S

>  <MolWeight> (977)
329.3736

>  <PCAT_CMPD_ID> (977)
WAY-646044

>  <CNC_ID> (977)
359338717

>  <transfer_container_id> (977)
PTN000000067

>  <COMPOUND_NUMBER> (977)
WAY-646044

>  <BAR_CODE_NO> (977)
90480641

>  <LOCATION_CODE> (977)
PTNCS

>  <AMOUNT_CURRENT> (977)
32.4

$$$$
WAY-646051
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11  2  1  0  0  0  0
 12 11  1  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15  7  1  0  0  0  0
 16  7  2  0  0  0  0
 17 13  1  0  0  0  0
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 20  4  1  0  0  0  0
 21  5  1  0  0  0  0
 22 17  2  0  0  0  0
 23 19  2  0  0  0  0
 24 22  1  0  0  0  0
  2  3  1  0  0  0  0
 13 14  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (978)
978

>  <Formula> (978)
C15H15N5O3S

>  <MolWeight> (978)
345.3763

>  <PCAT_CMPD_ID> (978)
WAY-646051

>  <CNC_ID> (978)
359338724

>  <transfer_container_id> (978)
PTN000000067

>  <COMPOUND_NUMBER> (978)
WAY-646051

>  <BAR_CODE_NO> (978)
90480648

>  <LOCATION_CODE> (978)
PTNCS

>  <AMOUNT_CURRENT> (978)
32.2

$$$$
WAY-646052
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (979)
979

>  <Formula> (979)
C17H16N2O4S2

>  <MolWeight> (979)
376.44994

>  <PCAT_CMPD_ID> (979)
WAY-646052

>  <CNC_ID> (979)
359338725

>  <transfer_container_id> (979)
PTN000000067

>  <COMPOUND_NUMBER> (979)
WAY-646052

>  <BAR_CODE_NO> (979)
90480649

>  <LOCATION_CODE> (979)
PTNCS

>  <AMOUNT_CURRENT> (979)
32.7

$$$$
WAY-646174
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (980)
980

>  <Formula> (980)
C25H22FN3O3S2

>  <MolWeight> (980)
495.5888832

>  <PCAT_CMPD_ID> (980)
WAY-646174

>  <CNC_ID> (980)
359338847

>  <transfer_container_id> (980)
PTN000000067

>  <COMPOUND_NUMBER> (980)
WAY-646174

>  <BAR_CODE_NO> (980)
90480771

>  <LOCATION_CODE> (980)
PTNCS

>  <AMOUNT_CURRENT> (980)
32.6

$$$$
WAY-646327
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (981)
981

>  <Formula> (981)
C23H27N5O

>  <MolWeight> (981)
389.49338

>  <PCAT_CMPD_ID> (981)
WAY-646327

>  <CNC_ID> (981)
359339000

>  <transfer_container_id> (981)
PTN000000067

>  <COMPOUND_NUMBER> (981)
WAY-646327

>  <BAR_CODE_NO> (981)
90480929

>  <LOCATION_CODE> (981)
PTNCS

>  <AMOUNT_CURRENT> (981)
32.6

$$$$
WAY-646396
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 18 15  2  0  0  0  0
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 23 25  2  0  0  0  0
M  END
>  <Mol_ID> (982)
982

>  <Formula> (982)
C20H16FN5O3S

>  <MolWeight> (982)
425.4361432

>  <PCAT_CMPD_ID> (982)
WAY-646396

>  <CNC_ID> (982)
359339069

>  <transfer_container_id> (982)
PTN000000067

>  <COMPOUND_NUMBER> (982)
WAY-646396

>  <BAR_CODE_NO> (982)
90481000

>  <LOCATION_CODE> (982)
PTNCS

>  <AMOUNT_CURRENT> (982)
32.4

$$$$
WAY-646426
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 16  6  1  0  0  0  0
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 19  7  2  0  0  0  0
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M  END
>  <Mol_ID> (983)
983

>  <Formula> (983)
C23H24N2O4S

>  <MolWeight> (983)
424.51266

>  <PCAT_CMPD_ID> (983)
WAY-646426

>  <CNC_ID> (983)
359339099

>  <transfer_container_id> (983)
PTN000000067

>  <COMPOUND_NUMBER> (983)
WAY-646426

>  <BAR_CODE_NO> (983)
90481031

>  <LOCATION_CODE> (983)
PTNCS

>  <AMOUNT_CURRENT> (983)
32.8

$$$$
WAY-646495
csChFnd80/10111816222D

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 16  4  1  0  0  0  0
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 18  5  1  0  0  0  0
 12 15  2  0  0  0  0
M  END
>  <Mol_ID> (984)
984

>  <Formula> (984)
C12H11NO4S2

>  <MolWeight> (984)
297.35004

>  <PCAT_CMPD_ID> (984)
WAY-646495

>  <CNC_ID> (984)
359339168

>  <transfer_container_id> (984)
PTN000000067

>  <COMPOUND_NUMBER> (984)
WAY-646495

>  <BAR_CODE_NO> (984)
90481100

>  <LOCATION_CODE> (984)
PTNCS

>  <AMOUNT_CURRENT> (984)
32.1

$$$$
WAY-646505
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  7  2  0  0  0  0
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 22  8  2  0  0  0  0
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 14  9  2  0  0  0  0
 16 10  2  0  0  0  0
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M  END
>  <Mol_ID> (985)
985

>  <Formula> (985)
C24H26N2O5

>  <MolWeight> (985)
422.47364

>  <PCAT_CMPD_ID> (985)
WAY-646505

>  <CNC_ID> (985)
359339178

>  <transfer_container_id> (985)
PTN000000067

>  <COMPOUND_NUMBER> (985)
WAY-646505

>  <BAR_CODE_NO> (985)
90481113

>  <LOCATION_CODE> (985)
PTNCS

>  <AMOUNT_CURRENT> (985)
32.4

$$$$
WAY-646506
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (986)
986

>  <Formula> (986)
C18H20N6O2

>  <MolWeight> (986)
352.3904

>  <PCAT_CMPD_ID> (986)
WAY-646506

>  <CNC_ID> (986)
359339179

>  <transfer_container_id> (986)
PTN000000067

>  <COMPOUND_NUMBER> (986)
WAY-646506

>  <BAR_CODE_NO> (986)
90481114

>  <LOCATION_CODE> (986)
PTNCS

>  <AMOUNT_CURRENT> (986)
32.9

$$$$
WAY-646517
csChFnd80/10111816222D

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 10  3  1  0  0  0  0
 11  3  2  0  0  0  0
 12  2  1  0  0  0  0
 13  2  1  0  0  0  0
 14 19  1  0  0  0  0
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 18  7  1  0  0  0  0
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 25 22  2  0  0  0  0
 26 24  2  0  0  0  0
 16 15  1  0  0  0  0
  9 20  1  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (987)
987

>  <Formula> (987)
C19H21NO5S

>  <MolWeight> (987)
375.43874

>  <PCAT_CMPD_ID> (987)
WAY-646517

>  <CNC_ID> (987)
359339190

>  <transfer_container_id> (987)
PTN000000067

>  <COMPOUND_NUMBER> (987)
WAY-646517

>  <BAR_CODE_NO> (987)
90481125

>  <LOCATION_CODE> (987)
PTNCS

>  <AMOUNT_CURRENT> (987)
32.7

$$$$
WAY-646544
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
    1.2792   -0.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  2  0  0  0  0
 11  7  1  0  0  0  0
 12  1  1  0  0  0  0
 13 15  1  0  0  0  0
 14  3  1  0  0  0  0
 15 11  2  0  0  0  0
 16 21  1  0  0  0  0
 17 24  1  0  0  0  0
 18 13  1  0  0  0  0
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 24 22  2  0  0  0  0
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 26 14  2  0  0  0  0
 27  2  1  0  0  0  0
 28 30  2  0  0  0  0
 29  4  1  0  0  0  0
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 31 25  2  0  0  0  0
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  3  4  1  0  0  0  0
 28 31  1  0  0  0  0
  7  8  2  0  0  0  0
 17 13  2  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (988)
988

>  <Formula> (988)
C23H18FN3O4S

>  <MolWeight> (988)
451.4701232

>  <PCAT_CMPD_ID> (988)
WAY-646544

>  <CNC_ID> (988)
359339217

>  <transfer_container_id> (988)
PTN000000067

>  <COMPOUND_NUMBER> (988)
WAY-646544

>  <BAR_CODE_NO> (988)
90481152

>  <LOCATION_CODE> (988)
PTNCS

>  <AMOUNT_CURRENT> (988)
32

$$$$
WAY-646920
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -0.1958   -2.4375    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4 13  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  2  1  0  0  0  0
 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12  1  2  0  0  0  0
 13  9  2  0  0  0  0
 14 17  2  0  0  0  0
 15  7  1  0  0  0  0
 16 19  1  0  0  0  0
 17  3  1  0  0  0  0
 18  8  1  0  0  0  0
 19 15  2  0  0  0  0
 20 16  1  0  0  0  0
 21  5  1  0  0  0  0
 22 14  1  0  0  0  0
  4  5  2  0  0  0  0
 22 21  2  0  0  0  0
 16 11  2  0  0  0  0
M  END
>  <Mol_ID> (989)
989

>  <Formula> (989)
C15H8BrFN2O3

>  <MolWeight> (989)
363.1380232

>  <PCAT_CMPD_ID> (989)
WAY-646920

>  <CNC_ID> (989)
359339593

>  <transfer_container_id> (989)
PTN000000067

>  <COMPOUND_NUMBER> (989)
WAY-646920

>  <BAR_CODE_NO> (989)
90481534

>  <LOCATION_CODE> (989)
PTNCS

>  <AMOUNT_CURRENT> (989)
32.4

$$$$
WAY-646944
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
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 10  8  2  0  0  0  0
 11 20  1  0  0  0  0
 12  2  2  0  0  0  0
 13 11  1  0  0  0  0
 14  7  1  0  0  0  0
 15  9  2  0  0  0  0
 16  7  2  0  0  0  0
 17 13  1  0  0  0  0
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 19  1  1  0  0  0  0
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 22  5  1  0  0  0  0
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 22 24  1  0  0  0  0
  6  3  2  0  0  0  0
 15 10  1  0  0  0  0
 27 23  1  0  0  0  0
M  END
>  <Mol_ID> (990)
990

>  <Formula> (990)
C21H19N3O4

>  <MolWeight> (990)
377.39326

>  <PCAT_CMPD_ID> (990)
WAY-646944

>  <CNC_ID> (990)
359339617

>  <transfer_container_id> (990)
PTN000000067

>  <COMPOUND_NUMBER> (990)
WAY-646944

>  <BAR_CODE_NO> (990)
90481558

>  <LOCATION_CODE> (990)
PTNCS

>  <AMOUNT_CURRENT> (990)
32.2

$$$$
WAY-646959
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
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 23  7  2  0  0  0  0
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 31 30  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (991)
991

>  <Formula> (991)
C20H21Cl2N3O5S

>  <MolWeight> (991)
486.36884

>  <PCAT_CMPD_ID> (991)
WAY-646959

>  <CNC_ID> (991)
359339632

>  <transfer_container_id> (991)
PTN000000067

>  <COMPOUND_NUMBER> (991)
WAY-646959

>  <BAR_CODE_NO> (991)
90481573

>  <LOCATION_CODE> (991)
PTNCS

>  <AMOUNT_CURRENT> (991)
32.4

$$$$
WAY-646986
csChFnd80/10111816222D

 32 35  0  0  1  0  0  0  0  0999 V2000
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 12  8  1  6  0  0  0
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 11  7  2  0  0  0  0
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 32 27  2  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (992)
992

>  <Formula> (992)
C24H23N3O4S

>  <MolWeight> (992)
449.52212

>  <PCAT_CMPD_ID> (992)
WAY-646986

>  <CNC_ID> (992)
359339659

>  <transfer_container_id> (992)
PTN000000067

>  <COMPOUND_NUMBER> (992)
WAY-646986

>  <BAR_CODE_NO> (992)
90481600

>  <LOCATION_CODE> (992)
PTNCS

>  <AMOUNT_CURRENT> (992)
32.7

$$$$
GI-505853
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.4991    0.3845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 13  1  0  0  0  0
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 15 16  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (993)
993

>  <Formula> (993)
C17H12O4

>  <MolWeight> (993)
280.27478

>  <PCAT_CMPD_ID> (993)
GI-505853

>  <CNC_ID> (993)
359339975

>  <transfer_container_id> (993)
PTN000000068

>  <COMPOUND_NUMBER> (993)
GI-505853

>  <BAR_CODE_NO> (993)
90463274

>  <LOCATION_CODE> (993)
PTNCS

>  <AMOUNT_CURRENT> (993)
32.6

$$$$
WAY-274029
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
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 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18 13  1  0  0  0  0
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 21 17  1  0  0  0  0
 22 16  2  0  0  0  0
 23 21  2  0  0  0  0
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 22 23  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (994)
994

>  <Formula> (994)
C16H15NO4S2

>  <MolWeight> (994)
349.4246

>  <PCAT_CMPD_ID> (994)
WAY-274029

>  <CNC_ID> (994)
359341293

>  <transfer_container_id> (994)
PTN000000068

>  <COMPOUND_NUMBER> (994)
WAY-274029

>  <BAR_CODE_NO> (994)
391974

>  <LOCATION_CODE> (994)
PTNCS

>  <AMOUNT_CURRENT> (994)
32.5

$$$$
WAY-277028
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  3  2  0  0  0  0
 12  9  1  0  0  0  0
 13 18  1  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16 13  1  0  0  0  0
 17  8  2  0  0  0  0
 18 21  2  0  0  0  0
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 20 15  2  0  0  0  0
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 23 17  1  0  0  0  0
 24 23  2  0  0  0  0
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 22 24  1  0  0  0  0
 19 13  2  0  0  0  0
M  END
>  <Mol_ID> (995)
995

>  <Formula> (995)
C16H11BrClN3OS2

>  <MolWeight> (995)
440.76504

>  <PCAT_CMPD_ID> (995)
WAY-277028

>  <CNC_ID> (995)
359341575

>  <transfer_container_id> (995)
PTN000000068

>  <COMPOUND_NUMBER> (995)
WAY-277028

>  <BAR_CODE_NO> (995)
389727

>  <LOCATION_CODE> (995)
PTNCS

>  <AMOUNT_CURRENT> (995)
32.5

$$$$
WAY-277034
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  4  6  2  0  0  0  0
 14 18  2  0  0  0  0
 22 15  2  0  0  0  0
M  END
>  <Mol_ID> (996)
996

>  <Formula> (996)
C16H11BrFN3OS2

>  <MolWeight> (996)
424.3104432

>  <PCAT_CMPD_ID> (996)
WAY-277034

>  <CNC_ID> (996)
359341581

>  <transfer_container_id> (996)
PTN000000068

>  <COMPOUND_NUMBER> (996)
WAY-277034

>  <BAR_CODE_NO> (996)
389733

>  <LOCATION_CODE> (996)
PTNCS

>  <AMOUNT_CURRENT> (996)
32.5

$$$$
WAY-277216
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  1  0  0  0  0
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  8 11  1  0  0  0  0
  9  7  1  0  0  0  0
 10  2  2  0  0  0  0
 11  3  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  2  0  0  0  0
 14  9  1  0  0  0  0
 15 14  2  0  0  0  0
 16 12  1  0  0  0  0
 17  6  1  0  0  0  0
 18 15  1  0  0  0  0
 19  9  2  0  0  0  0
 20 19  1  0  0  0  0
 21 12  1  0  0  0  0
 22 20  2  0  0  0  0
 23 18  1  0  0  0  0
 24 17  2  0  0  0  0
 25 24  1  0  0  0  0
  5  4  1  0  0  0  0
 25 21  2  0  0  0  0
 22 15  1  0  0  0  0
M  END
>  <Mol_ID> (997)
997

>  <Formula> (997)
C17H15ClN4O2S

>  <MolWeight> (997)
374.8446

>  <PCAT_CMPD_ID> (997)
WAY-277216

>  <CNC_ID> (997)
359341762

>  <transfer_container_id> (997)
PTN000000068

>  <COMPOUND_NUMBER> (997)
WAY-277216

>  <BAR_CODE_NO> (997)
389916

>  <LOCATION_CODE> (997)
PTNCS

>  <AMOUNT_CURRENT> (997)
32.5

$$$$
WAY-277750
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   -3.1750    2.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
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  6 10  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  1  1  0  0  0  0
 10  3  1  0  0  0  0
 11  8  2  0  0  0  0
 12  9  1  0  0  0  0
 13  6  2  0  0  0  0
 14  6  2  0  0  0  0
 15 12  2  0  0  0  0
 16 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18 17  1  0  0  0  0
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 20  8  1  0  0  0  0
 21 18  2  0  0  0  0
 22 18  1  0  0  0  0
 23 22  2  0  0  0  0
 24 21  1  0  0  0  0
 25 11  1  0  0  0  0
 26 19  1  0  0  0  0
 27 20  2  0  0  0  0
 28 27  1  0  0  0  0
 29 16  1  0  0  0  0
 30 26  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  1  0  0  0  0
 28 16  2  0  0  0  0
 19 24  2  0  0  0  0
M  END
>  <Mol_ID> (998)
998

>  <Formula> (998)
C22H23N3O4S

>  <MolWeight> (998)
425.50072

>  <PCAT_CMPD_ID> (998)
WAY-277750

>  <CNC_ID> (998)
359342295

>  <transfer_container_id> (998)
PTN000000068

>  <COMPOUND_NUMBER> (998)
WAY-277750

>  <BAR_CODE_NO> (998)
390450

>  <LOCATION_CODE> (998)
PTNCS

>  <AMOUNT_CURRENT> (998)
32.5

$$$$
WAY-277876
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  2  2  0  0  0  0
 12  2  2  0  0  0  0
 13  8  2  0  0  0  0
 14  7  2  0  0  0  0
 15  4  1  0  0  0  0
 16 10  2  0  0  0  0
 17 10  1  0  0  0  0
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 19 21  2  0  0  0  0
 27 24  2  0  0  0  0
M  END
>  <Mol_ID> (999)
999

>  <Formula> (999)
C17H14BrN3O5S

>  <MolWeight> (999)
452.27916

>  <PCAT_CMPD_ID> (999)
WAY-277876

>  <CNC_ID> (999)
359342421

>  <transfer_container_id> (999)
PTN000000068

>  <COMPOUND_NUMBER> (999)
WAY-277876

>  <BAR_CODE_NO> (999)
390576

>  <LOCATION_CODE> (999)
PTNCS

>  <AMOUNT_CURRENT> (999)
32.5

$$$$
WAY-277890
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  3  2  0  0  0  0
 12  5  2  0  0  0  0
 13 10  2  0  0  0  0
 14  1  1  0  0  0  0
 15 13  1  0  0  0  0
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 17 10  1  0  0  0  0
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 20 17  2  0  0  0  0
 21 20  1  0  0  0  0
 16  9  1  0  0  0  0
  2  7  2  0  0  0  0
 21 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,000)
1000

>  <Formula> (1,000)
C14H13N3O2S2

>  <MolWeight> (1,000)
319.40192

>  <PCAT_CMPD_ID> (1,000)
WAY-277890

>  <CNC_ID> (1,000)
359342435

>  <transfer_container_id> (1,000)
PTN000000068

>  <COMPOUND_NUMBER> (1,000)
WAY-277890

>  <BAR_CODE_NO> (1,000)
390594

>  <LOCATION_CODE> (1,000)
PTNCS

>  <AMOUNT_CURRENT> (1,000)
32.5

$$$$
WAY-277933
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  2  2  0  0  0  0
 12  9  2  0  0  0  0
 13  6  2  0  0  0  0
 14 15  2  0  0  0  0
 15 13  1  0  0  0  0
 16  9  1  0  0  0  0
 17  5  1  0  0  0  0
 18  4  1  0  0  0  0
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 20  7  1  0  0  0  0
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  7  8  1  0  0  0  0
 14 12  1  0  0  0  0
 24 19  2  0  0  0  0
 25 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,001)
1001

>  <Formula> (1,001)
C22H17NO4

>  <MolWeight> (1,001)
359.37468

>  <PCAT_CMPD_ID> (1,001)
WAY-277933

>  <CNC_ID> (1,001)
359342478

>  <transfer_container_id> (1,001)
PTN000000068

>  <COMPOUND_NUMBER> (1,001)
WAY-277933

>  <BAR_CODE_NO> (1,001)
390638

>  <LOCATION_CODE> (1,001)
PTNCS

>  <AMOUNT_CURRENT> (1,001)
32.5

$$$$
WAY-278038
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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  2 10  1  0  0  0  0
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  6  4  1  0  0  0  0
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 10 17  1  0  0  0  0
 11  2  2  0  0  0  0
 12  2  2  0  0  0  0
 13  9  1  0  0  0  0
 14  6  1  0  0  0  0
 15  9  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 13  2  0  0  0  0
 19 13  1  0  0  0  0
 20 27  1  0  0  0  0
 21  8  1  0  0  0  0
 22  8  1  0  0  0  0
 23  4  1  0  0  0  0
 24  7  1  0  0  0  0
 25 14  1  0  0  0  0
 26 21  1  0  0  0  0
 27 22  1  0  0  0  0
 28 24  2  0  0  0  0
 29 14  2  0  0  0  0
 30 25  1  0  0  0  0
 31 30  1  0  0  0  0
  7  6  2  0  0  0  0
 29 28  1  0  0  0  0
 16 10  2  0  0  0  0
 26 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,002)
1002

>  <Formula> (1,002)
C21H23N3O5S2

>  <MolWeight> (1,002)
461.55442

>  <PCAT_CMPD_ID> (1,002)
WAY-278038

>  <CNC_ID> (1,002)
359342583

>  <transfer_container_id> (1,002)
PTN000000068

>  <COMPOUND_NUMBER> (1,002)
WAY-278038

>  <BAR_CODE_NO> (1,002)
390743

>  <LOCATION_CODE> (1,002)
PTNCS

>  <AMOUNT_CURRENT> (1,002)
32.5

$$$$
WAY-278089
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  8  5  1  0  0  0  0
  9 12  1  0  0  0  0
 10  8  1  0  0  0  0
 11  5  2  0  0  0  0
 12  1  1  0  0  0  0
 13 11  1  0  0  0  0
 14  3  1  0  0  0  0
 15  2  2  0  0  0  0
 16  4  1  0  0  0  0
 17  9  2  0  0  0  0
 18  6  1  0  0  0  0
 19 10  1  0  0  0  0
 20 14  2  0  0  0  0
 21 20  1  0  0  0  0
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 27 26  2  0  0  0  0
  7  6  1  0  0  0  0
 13 10  2  0  0  0  0
 27 25  1  0  0  0  0
 18 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,003)
1003

>  <Formula> (1,003)
C21H17BrN2O3

>  <MolWeight> (1,003)
425.27528

>  <PCAT_CMPD_ID> (1,003)
WAY-278089

>  <CNC_ID> (1,003)
359342634

>  <transfer_container_id> (1,003)
PTN000000068

>  <COMPOUND_NUMBER> (1,003)
WAY-278089

>  <BAR_CODE_NO> (1,003)
390794

>  <LOCATION_CODE> (1,003)
PTNCS

>  <AMOUNT_CURRENT> (1,003)
32.5

$$$$
WAY-278155
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  8  1  0  0  0  0
 12  3  2  0  0  0  0
 13  8  2  0  0  0  0
 14  4  1  0  0  0  0
 15  7  2  0  0  0  0
 16 11  1  0  0  0  0
 17  5  1  0  0  0  0
 18 13  1  0  0  0  0
 19 10  2  0  0  0  0
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 22 14  1  0  0  0  0
 23 14  2  0  0  0  0
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  6  5  1  0  0  0  0
 18 16  2  0  0  0  0
 26 24  1  0  0  0  0
 17 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,004)
1004

>  <Formula> (1,004)
C20H15ClN2O3

>  <MolWeight> (1,004)
366.7977

>  <PCAT_CMPD_ID> (1,004)
WAY-278155

>  <CNC_ID> (1,004)
359342700

>  <transfer_container_id> (1,004)
PTN000000068

>  <COMPOUND_NUMBER> (1,004)
WAY-278155

>  <BAR_CODE_NO> (1,004)
390860

>  <LOCATION_CODE> (1,004)
PTNCS

>  <AMOUNT_CURRENT> (1,004)
32.5

$$$$
WAY-335256
csChFnd80/10111816222D

 33 35  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  3  1  0  0  0  0
 13  3  1  0  0  0  0
 14 21  1  0  0  0  0
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 17  4  2  0  0  0  0
 18  7  2  0  0  0  0
 19  5  1  0  0  0  0
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 22  9  1  0  0  0  0
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 25  7  1  0  0  0  0
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 15  6  1  0  0  0  0
  2 14  2  0  0  0  0
 24 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,005)
1005

>  <Formula> (1,005)
C23H28FN3O5S

>  <MolWeight> (1,005)
477.5489232

>  <PCAT_CMPD_ID> (1,005)
WAY-335256

>  <CNC_ID> (1,005)
359344517

>  <transfer_container_id> (1,005)
PTN000000068

>  <COMPOUND_NUMBER> (1,005)
WAY-335256

>  <BAR_CODE_NO> (1,005)
310257

>  <LOCATION_CODE> (1,005)
PTNCS

>  <AMOUNT_CURRENT> (1,005)
32.5

$$$$
WAY-628649
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  5  2  0  0  0  0
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 10  8  2  0  0  0  0
 11  7  1  0  0  0  0
 12 18  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16  6  2  0  0  0  0
 17  8  1  0  0  0  0
 18 17  2  0  0  0  0
 19  4  1  0  0  0  0
 20  5  1  0  0  0  0
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 12  9  2  0  0  0  0
 15 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,006)
1006

>  <Formula> (1,006)
C14H13NO5

>  <MolWeight> (1,006)
275.25672

>  <PCAT_CMPD_ID> (1,006)
WAY-628649

>  <CNC_ID> (1,006)
359349800

>  <transfer_container_id> (1,006)
PTN000000068

>  <COMPOUND_NUMBER> (1,006)
WAY-628649

>  <BAR_CODE_NO> (1,006)
90462910

>  <LOCATION_CODE> (1,006)
PTNCS

>  <AMOUNT_CURRENT> (1,006)
32.8

$$$$
WAY-628654
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12  7  2  0  0  0  0
 13 17  2  0  0  0  0
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 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20  8  1  0  0  0  0
 21 10  1  0  0  0  0
  3  2  1  0  0  0  0
 10  8  2  0  0  0  0
M  END
>  <Mol_ID> (1,007)
1007

>  <Formula> (1,007)
C16H19NO4

>  <MolWeight> (1,007)
289.32636

>  <PCAT_CMPD_ID> (1,007)
WAY-628654

>  <CNC_ID> (1,007)
359349805

>  <transfer_container_id> (1,007)
PTN000000068

>  <COMPOUND_NUMBER> (1,007)
WAY-628654

>  <BAR_CODE_NO> (1,007)
90462915

>  <LOCATION_CODE> (1,007)
PTNCS

>  <AMOUNT_CURRENT> (1,007)
32.7

$$$$
WAY-628663
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11 12  2  0  0  0  0
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 15 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,008)
1008

>  <Formula> (1,008)
C13H15N3O2S2

>  <MolWeight> (1,008)
309.4071

>  <PCAT_CMPD_ID> (1,008)
WAY-628663

>  <CNC_ID> (1,008)
359349814

>  <transfer_container_id> (1,008)
PTN000000068

>  <COMPOUND_NUMBER> (1,008)
WAY-628663

>  <BAR_CODE_NO> (1,008)
90462924

>  <LOCATION_CODE> (1,008)
PTNCS

>  <AMOUNT_CURRENT> (1,008)
32.5

$$$$
WAY-628671
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 20  3  1  0  0  0  0
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 10  6  1  0  0  0  0
 18 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,009)
1009

>  <Formula> (1,009)
C20H19FN4O3

>  <MolWeight> (1,009)
382.3882632

>  <PCAT_CMPD_ID> (1,009)
WAY-628671

>  <CNC_ID> (1,009)
359349822

>  <transfer_container_id> (1,009)
PTN000000068

>  <COMPOUND_NUMBER> (1,009)
WAY-628671

>  <BAR_CODE_NO> (1,009)
90462932

>  <LOCATION_CODE> (1,009)
PTNCS

>  <AMOUNT_CURRENT> (1,009)
32.2

$$$$
WAY-628713
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 14  7  1  0  0  0  0
 15 11  1  0  0  0  0
 16 10  1  0  0  0  0
 17  3  2  0  0  0  0
 18  4  2  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
 21  9  1  0  0  0  0
 22 12  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
 25 22  1  0  0  0  0
 26 23  1  0  0  0  0
  5  6  1  0  0  0  0
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 13 10  1  0  0  0  0
 16 15  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,010)
1010

>  <Formula> (1,010)
C19H19NO5S

>  <MolWeight> (1,010)
373.42286

>  <PCAT_CMPD_ID> (1,010)
WAY-628713

>  <CNC_ID> (1,010)
359349864

>  <transfer_container_id> (1,010)
PTN000000068

>  <COMPOUND_NUMBER> (1,010)
WAY-628713

>  <BAR_CODE_NO> (1,010)
90462974

>  <LOCATION_CODE> (1,010)
PTNCS

>  <AMOUNT_CURRENT> (1,010)
32.7

$$$$
WAY-628723
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  2  0  0  0  0
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  9  3  1  0  0  0  0
 10  1  1  0  0  0  0
 11  4  2  0  0  0  0
 12 17  1  0  0  0  0
 13  5  1  0  0  0  0
 14  8  1  0  0  0  0
 15  8  1  0  0  0  0
 16  7  1  0  0  0  0
 17 15  1  0  0  0  0
 18 14  1  0  0  0  0
 19  9  1  0  0  0  0
 20  9  2  0  0  0  0
 21 13  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
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 25 23  2  0  0  0  0
  6  4  1  0  0  0  0
 25 24  1  0  0  0  0
 22 16  2  0  0  0  0
 12 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,011)
1011

>  <Formula> (1,011)
C20H21N3O2

>  <MolWeight> (1,011)
335.39964

>  <PCAT_CMPD_ID> (1,011)
WAY-628723

>  <CNC_ID> (1,011)
359349874

>  <transfer_container_id> (1,011)
PTN000000068

>  <COMPOUND_NUMBER> (1,011)
WAY-628723

>  <BAR_CODE_NO> (1,011)
90462986

>  <LOCATION_CODE> (1,011)
PTNCS

>  <AMOUNT_CURRENT> (1,011)
32

$$$$
WAY-628769
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    0.2375    1.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  2  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  1  2  0  0  0  0
 10 12  1  0  0  0  0
 11  6  1  0  0  0  0
 12 11  2  0  0  0  0
 13 19  1  0  0  0  0
 14  5  1  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 17  4  1  0  0  0  0
 18  4  1  0  0  0  0
 19 18  1  0  0  0  0
 20 17  1  0  0  0  0
 21 10  1  0  0  0  0
 13 20  1  0  0  0  0
 10  8  2  0  0  0  0
M  END
>  <Mol_ID> (1,012)
1012

>  <Formula> (1,012)
C14H15Cl2FN2O2

>  <MolWeight> (1,012)
333.1855032

>  <PCAT_CMPD_ID> (1,012)
WAY-628769

>  <CNC_ID> (1,012)
359349920

>  <transfer_container_id> (1,012)
PTN000000068

>  <COMPOUND_NUMBER> (1,012)
WAY-628769

>  <BAR_CODE_NO> (1,012)
90463036

>  <LOCATION_CODE> (1,012)
PTNCS

>  <AMOUNT_CURRENT> (1,012)
32.2

$$$$
WAY-628919
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7 12  1  0  0  0  0
  8  5  1  0  0  0  0
  9  5  2  0  0  0  0
 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 13  2  1  0  0  0  0
 14 11  1  0  0  0  0
 15 17  1  0  0  0  0
 16  6  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  2  0  0  0  0
 19 15  1  0  0  0  0
 20 19  2  0  0  0  0
 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
  3  6  1  0  0  0  0
 22 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,013)
1013

>  <Formula> (1,013)
C17H19NO4

>  <MolWeight> (1,013)
301.33706

>  <PCAT_CMPD_ID> (1,013)
WAY-628919

>  <CNC_ID> (1,013)
359350070

>  <transfer_container_id> (1,013)
PTN000000068

>  <COMPOUND_NUMBER> (1,013)
WAY-628919

>  <BAR_CODE_NO> (1,013)
90463191

>  <LOCATION_CODE> (1,013)
PTNCS

>  <AMOUNT_CURRENT> (1,013)
32.4

$$$$
WAY-629084
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12  1  2  0  0  0  0
 13 17  2  0  0  0  0
 14  2  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 18  1  0  0  0  0
 18  6  1  0  0  0  0
 19  4  2  0  0  0  0
 20 17  1  0  0  0  0
 21  4  1  0  0  0  0
 22 24  1  0  0  0  0
 23  7  1  0  0  0  0
 24 21  2  0  0  0  0
 22 15  2  0  0  0  0
  8  5  2  0  0  0  0
 11 10  1  0  0  0  0
M  END
>  <Mol_ID> (1,014)
1014

>  <Formula> (1,014)
C17H16N2O5

>  <MolWeight> (1,014)
328.31934

>  <PCAT_CMPD_ID> (1,014)
WAY-629084

>  <CNC_ID> (1,014)
359350234

>  <transfer_container_id> (1,014)
PTN000000068

>  <COMPOUND_NUMBER> (1,014)
WAY-629084

>  <BAR_CODE_NO> (1,014)
90463363

>  <LOCATION_CODE> (1,014)
PTNCS

>  <AMOUNT_CURRENT> (1,014)
32.1

$$$$
WAY-629131
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16 12  2  0  0  0  0
 17 16  1  0  0  0  0
 18 15  2  0  0  0  0
 19 14  1  0  0  0  0
 20 14  2  0  0  0  0
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 22 19  2  0  0  0  0
 23 21  2  0  0  0  0
  4  3  1  0  0  0  0
 13 18  1  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,015)
1015

>  <Formula> (1,015)
C18H17NO4

>  <MolWeight> (1,015)
311.33188

>  <PCAT_CMPD_ID> (1,015)
WAY-629131

>  <CNC_ID> (1,015)
359350281

>  <transfer_container_id> (1,015)
PTN000000068

>  <COMPOUND_NUMBER> (1,015)
WAY-629131

>  <BAR_CODE_NO> (1,015)
90463412

>  <LOCATION_CODE> (1,015)
PTNCS

>  <AMOUNT_CURRENT> (1,015)
32.6

$$$$
WAY-629493
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4 15  1  0  0  0  0
  5  7  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 11  3  2  0  0  0  0
 12  4  1  0  0  0  0
 13  6  2  0  0  0  0
 14  6  1  0  0  0  0
 15  9  1  0  0  0  0
 16  8  1  0  0  0  0
 17 19  1  0  0  0  0
 18 13  1  0  0  0  0
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 27 23  2  0  0  0  0
 28 26  2  0  0  0  0
  4 16  1  0  0  0  0
 17 18  2  0  0  0  0
 28 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,016)
1016

>  <Formula> (1,016)
C22H27N3O3

>  <MolWeight> (1,016)
381.46808

>  <PCAT_CMPD_ID> (1,016)
WAY-629493

>  <CNC_ID> (1,016)
359350643

>  <transfer_container_id> (1,016)
PTN000000068

>  <COMPOUND_NUMBER> (1,016)
WAY-629493

>  <BAR_CODE_NO> (1,016)
90463792

>  <LOCATION_CODE> (1,016)
PTNCS

>  <AMOUNT_CURRENT> (1,016)
32.8

$$$$
WAY-311677
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
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 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 19 21  2  0  0  0  0
  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,017)
1017

>  <Formula> (1,017)
C16H13N3OS

>  <MolWeight> (1,017)
295.35892

>  <PCAT_CMPD_ID> (1,017)
WAY-311677

>  <CNC_ID> (1,017)
359315418

>  <transfer_container_id> (1,017)
PTN000000065

>  <COMPOUND_NUMBER> (1,017)
WAY-311677

>  <BAR_CODE_NO> (1,017)
3916133

>  <LOCATION_CODE> (1,017)
PTNCS

>  <AMOUNT_CURRENT> (1,017)
33.3

$$$$
WAY-345081
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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 10 16  2  0  0  0  0
 11  3  2  0  0  0  0
 12  1  1  0  0  0  0
 13  8  1  0  0  0  0
 14  7  2  0  0  0  0
 15 10  1  0  0  0  0
 16 14  1  0  0  0  0
 17  5  2  0  0  0  0
 18  6  2  0  0  0  0
 19 13  1  0  0  0  0
 20 15  1  0  0  0  0
 21 17  1  0  0  0  0
 22 21  2  0  0  0  0
  4  6  1  0  0  0  0
 18 22  1  0  0  0  0
  8 10  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,018)
1018

>  <Formula> (1,018)
C17H13NO4

>  <MolWeight> (1,018)
295.28942

>  <PCAT_CMPD_ID> (1,018)
WAY-345081

>  <CNC_ID> (1,018)
359320391

>  <transfer_container_id> (1,018)
PTN000000065

>  <COMPOUND_NUMBER> (1,018)
WAY-345081

>  <BAR_CODE_NO> (1,018)
2555472

>  <LOCATION_CODE> (1,018)
PTNCS

>  <AMOUNT_CURRENT> (1,018)
32.4

$$$$
WAY-313209
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 16  1  0  0  0  0
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 20 24  1  0  0  0  0
 23 25  1  0  0  0  0
  9 12  2  0  0  0  0
 11 16  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,019)
1019

>  <Formula> (1,019)
C21H19N3O

>  <MolWeight> (1,019)
329.39506

>  <PCAT_CMPD_ID> (1,019)
WAY-313209

>  <CNC_ID> (1,019)
359328245

>  <transfer_container_id> (1,019)
PTN000000067

>  <COMPOUND_NUMBER> (1,019)
WAY-313209

>  <BAR_CODE_NO> (1,019)
3918039

>  <LOCATION_CODE> (1,019)
PTNCS

>  <AMOUNT_CURRENT> (1,019)
33.7

$$$$
WAY-313128
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  5  2  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
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 15  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,020)
1020

>  <Formula> (1,020)
C17H19ClN2O3

>  <MolWeight> (1,020)
334.79736

>  <PCAT_CMPD_ID> (1,020)
WAY-313128

>  <CNC_ID> (1,020)
359328164

>  <transfer_container_id> (1,020)
PTN000000067

>  <COMPOUND_NUMBER> (1,020)
WAY-313128

>  <BAR_CODE_NO> (1,020)
3917930

>  <LOCATION_CODE> (1,020)
PTNCS

>  <AMOUNT_CURRENT> (1,020)
33.9

$$$$
WAY-233304
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
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 10  7  1  0  0  0  0
 11 16  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  2  0  0  0  0
 14 10  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  2  0  0  0  0
  5  6  1  0  0  0  0
 11 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,021)
1021

>  <Formula> (1,021)
C11H8Cl2N2O

>  <MolWeight> (1,021)
255.10002

>  <PCAT_CMPD_ID> (1,021)
WAY-233304

>  <CNC_ID> (1,021)
359326894

>  <transfer_container_id> (1,021)
PTN000000067

>  <COMPOUND_NUMBER> (1,021)
WAY-233304

>  <BAR_CODE_NO> (1,021)
3917827

>  <LOCATION_CODE> (1,021)
PTNCS

>  <AMOUNT_CURRENT> (1,021)
33.2

$$$$
CL-421120
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  9 12  1  0  0  0  0
 15 18  1  0  0  0  0
 23 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,022)
1022

>  <Formula> (1,022)
C18H21N3O5

>  <MolWeight> (1,022)
359.37644

>  <PCAT_CMPD_ID> (1,022)
CL-421120

>  <CNC_ID> (1,022)
359326750

>  <transfer_container_id> (1,022)
PTN000000067

>  <COMPOUND_NUMBER> (1,022)
CL-421120

>  <BAR_CODE_NO> (1,022)
3917659

>  <LOCATION_CODE> (1,022)
PTNCS

>  <AMOUNT_CURRENT> (1,022)
33.7

$$$$
WAY-235285
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 12  3  2  0  0  0  0
 13  9  2  0  0  0  0
 14  7  2  0  0  0  0
 15  8  1  0  0  0  0
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  4  8  2  0  0  0  0
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 27 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,023)
1023

>  <Formula> (1,023)
C22H14BrClN2O2

>  <MolWeight> (1,023)
453.71576

>  <PCAT_CMPD_ID> (1,023)
WAY-235285

>  <CNC_ID> (1,023)
359313935

>  <transfer_container_id> (1,023)
PTN000000065

>  <COMPOUND_NUMBER> (1,023)
WAY-235285

>  <BAR_CODE_NO> (1,023)
3915927

>  <LOCATION_CODE> (1,023)
PTNCS

>  <AMOUNT_CURRENT> (1,023)
33.6

$$$$
WAY-239147
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  5  2  0  0  0  0
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 15  7  2  0  0  0  0
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 18  9  1  0  0  0  0
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 11  8  2  0  0  0  0
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M  END
>  <Mol_ID> (1,024)
1024

>  <Formula> (1,024)
C18H19NO2

>  <MolWeight> (1,024)
281.34896

>  <PCAT_CMPD_ID> (1,024)
WAY-239147

>  <CNC_ID> (1,024)
359313962

>  <transfer_container_id> (1,024)
PTN000000065

>  <COMPOUND_NUMBER> (1,024)
WAY-239147

>  <BAR_CODE_NO> (1,024)
3916692

>  <LOCATION_CODE> (1,024)
PTNCS

>  <AMOUNT_CURRENT> (1,024)
33.5

$$$$
WAY-312190
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,025)
1025

>  <Formula> (1,025)
C19H21NO3

>  <MolWeight> (1,025)
311.37494

>  <PCAT_CMPD_ID> (1,025)
WAY-312190

>  <CNC_ID> (1,025)
359315930

>  <transfer_container_id> (1,025)
PTN000000065

>  <COMPOUND_NUMBER> (1,025)
WAY-312190

>  <BAR_CODE_NO> (1,025)
3916787

>  <LOCATION_CODE> (1,025)
PTNCS

>  <AMOUNT_CURRENT> (1,025)
33.7

$$$$
WAY-311069
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 16 21  2  0  0  0  0
 19 22  2  0  0  0  0
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M  END
>  <Mol_ID> (1,026)
1026

>  <Formula> (1,026)
C20H14ClNO3

>  <MolWeight> (1,026)
351.78306

>  <PCAT_CMPD_ID> (1,026)
WAY-311069

>  <CNC_ID> (1,026)
359314811

>  <transfer_container_id> (1,026)
PTN000000065

>  <COMPOUND_NUMBER> (1,026)
WAY-311069

>  <BAR_CODE_NO> (1,026)
3915414

>  <LOCATION_CODE> (1,026)
PTNCS

>  <AMOUNT_CURRENT> (1,026)
33.1

$$$$
WAY-311696
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  2  2  0  0  0  0
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 13  6  2  0  0  0  0
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 15  9  2  0  0  0  0
 16  1  1  0  0  0  0
 17  3  1  0  0  0  0
 18 15  1  0  0  0  0
 19  5  2  0  0  0  0
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 21  7  2  0  0  0  0
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  7  3  1  0  0  0  0
 25 21  1  0  0  0  0
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 20 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,027)
1027

>  <Formula> (1,027)
C20H19NO4

>  <MolWeight> (1,027)
337.36916

>  <PCAT_CMPD_ID> (1,027)
WAY-311696

>  <CNC_ID> (1,027)
359315437

>  <transfer_container_id> (1,027)
PTN000000065

>  <COMPOUND_NUMBER> (1,027)
WAY-311696

>  <BAR_CODE_NO> (1,027)
3916162

>  <LOCATION_CODE> (1,027)
PTNCS

>  <AMOUNT_CURRENT> (1,027)
33.8

$$$$
WAY-312930
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,028)
1028

>  <Formula> (1,028)
C19H14FNO

>  <MolWeight> (1,028)
291.3189632

>  <PCAT_CMPD_ID> (1,028)
WAY-312930

>  <CNC_ID> (1,028)
359327967

>  <transfer_container_id> (1,028)
PTN000000067

>  <COMPOUND_NUMBER> (1,028)
WAY-312930

>  <BAR_CODE_NO> (1,028)
3917676

>  <LOCATION_CODE> (1,028)
PTNCS

>  <AMOUNT_CURRENT> (1,028)
33.2

$$$$
WAY-239417
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,029)
1029

>  <Formula> (1,029)
C17H15F2NO

>  <MolWeight> (1,029)
287.3039064

>  <PCAT_CMPD_ID> (1,029)
WAY-239417

>  <CNC_ID> (1,029)
359313964

>  <transfer_container_id> (1,029)
PTN000000065

>  <COMPOUND_NUMBER> (1,029)
WAY-239417

>  <BAR_CODE_NO> (1,029)
3915322

>  <LOCATION_CODE> (1,029)
PTNCS

>  <AMOUNT_CURRENT> (1,029)
33.1

$$$$
WAY-312102
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,030)
1030

>  <Formula> (1,030)
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>  <MolWeight> (1,030)
305.73952

>  <PCAT_CMPD_ID> (1,030)
WAY-312102

>  <CNC_ID> (1,030)
359315842

>  <transfer_container_id> (1,030)
PTN000000065

>  <COMPOUND_NUMBER> (1,030)
WAY-312102

>  <BAR_CODE_NO> (1,030)
3916674

>  <LOCATION_CODE> (1,030)
PTNCS

>  <AMOUNT_CURRENT> (1,030)
33.4

$$$$
WAY-311239
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,031)
1031

>  <Formula> (1,031)
C17H16N2O

>  <MolWeight> (1,031)
264.32174

>  <PCAT_CMPD_ID> (1,031)
WAY-311239

>  <CNC_ID> (1,031)
359314980

>  <transfer_container_id> (1,031)
PTN000000065

>  <COMPOUND_NUMBER> (1,031)
WAY-311239

>  <BAR_CODE_NO> (1,031)
3915609

>  <LOCATION_CODE> (1,031)
PTNCS

>  <AMOUNT_CURRENT> (1,031)
33.7

$$$$
WAY-311698
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 13 16  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,032)
1032

>  <Formula> (1,032)
C17H20N2OS

>  <MolWeight> (1,032)
300.4185

>  <PCAT_CMPD_ID> (1,032)
WAY-311698

>  <CNC_ID> (1,032)
359315439

>  <transfer_container_id> (1,032)
PTN000000065

>  <COMPOUND_NUMBER> (1,032)
WAY-311698

>  <BAR_CODE_NO> (1,032)
3916165

>  <LOCATION_CODE> (1,032)
PTNCS

>  <AMOUNT_CURRENT> (1,032)
33.3

$$$$
WAY-310947
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,033)
1033

>  <Formula> (1,033)
C16H20FNO2S

>  <MolWeight> (1,033)
309.3989032

>  <PCAT_CMPD_ID> (1,033)
WAY-310947

>  <CNC_ID> (1,033)
359314689

>  <transfer_container_id> (1,033)
PTN000000065

>  <COMPOUND_NUMBER> (1,033)
WAY-310947

>  <BAR_CODE_NO> (1,033)
3915257

>  <LOCATION_CODE> (1,033)
PTNCS

>  <AMOUNT_CURRENT> (1,033)
33.7

$$$$
WAY-310527
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,034)
1034

>  <Formula> (1,034)
C11H15NO2

>  <MolWeight> (1,034)
193.2423

>  <PCAT_CMPD_ID> (1,034)
WAY-310527

>  <CNC_ID> (1,034)
359314268

>  <transfer_container_id> (1,034)
PTN000000065

>  <COMPOUND_NUMBER> (1,034)
WAY-310527

>  <BAR_CODE_NO> (1,034)
3914755

>  <LOCATION_CODE> (1,034)
PTNCS

>  <AMOUNT_CURRENT> (1,034)
33.2

$$$$
WAY-311065
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,035)
1035

>  <Formula> (1,035)
C15H12N2O3S

>  <MolWeight> (1,035)
300.33238

>  <PCAT_CMPD_ID> (1,035)
WAY-311065

>  <CNC_ID> (1,035)
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>  <transfer_container_id> (1,035)
PTN000000065

>  <COMPOUND_NUMBER> (1,035)
WAY-311065

>  <BAR_CODE_NO> (1,035)
3915409

>  <LOCATION_CODE> (1,035)
PTNCS

>  <AMOUNT_CURRENT> (1,035)
33.2

$$$$
WAY-312071
csChFnd80/10111816222D

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  1  2  1  0  0  0  0
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 16 19  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,036)
1036

>  <Formula> (1,036)
C22H24N2O4S

>  <MolWeight> (1,036)
412.50196

>  <PCAT_CMPD_ID> (1,036)
WAY-312071

>  <CNC_ID> (1,036)
359315812

>  <transfer_container_id> (1,036)
PTN000000065

>  <COMPOUND_NUMBER> (1,036)
WAY-312071

>  <BAR_CODE_NO> (1,036)
3916638

>  <LOCATION_CODE> (1,036)
PTNCS

>  <AMOUNT_CURRENT> (1,036)
33.6

$$$$
WAY-311406
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
  9 13  1  0  0  0  0
 16 18  1  0  0  0  0
 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,037)
1037

>  <Formula> (1,037)
C20H17N3O4S

>  <MolWeight> (1,037)
395.43168

>  <PCAT_CMPD_ID> (1,037)
WAY-311406

>  <CNC_ID> (1,037)
359315147

>  <transfer_container_id> (1,037)
PTN000000065

>  <COMPOUND_NUMBER> (1,037)
WAY-311406

>  <BAR_CODE_NO> (1,037)
3915790

>  <LOCATION_CODE> (1,037)
PTNCS

>  <AMOUNT_CURRENT> (1,037)
33.8

$$$$
WAY-314129
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 17 19  1  0  0  0  0
  6  8  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,038)
1038

>  <Formula> (1,038)
C12H12ClN3O2S

>  <MolWeight> (1,038)
297.76058

>  <PCAT_CMPD_ID> (1,038)
WAY-314129

>  <CNC_ID> (1,038)
359329165

>  <transfer_container_id> (1,038)
PTN000000067

>  <COMPOUND_NUMBER> (1,038)
WAY-314129

>  <BAR_CODE_NO> (1,038)
1363774

>  <LOCATION_CODE> (1,038)
PTNCS

>  <AMOUNT_CURRENT> (1,038)
33

$$$$
GI-566036
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10 18  3  0  0  0  0
 11 19  1  0  0  0  0
 19 20  1  0  0  0  0
  9 14  1  0  0  0  0
 13 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,039)
1039

>  <Formula> (1,039)
C15H14N4S

>  <MolWeight> (1,039)
282.36346

>  <PCAT_CMPD_ID> (1,039)
GI-566036

>  <CNC_ID> (1,039)
359326790

>  <transfer_container_id> (1,039)
PTN000000067

>  <COMPOUND_NUMBER> (1,039)
GI-566036

>  <BAR_CODE_NO> (1,039)
3917543

>  <LOCATION_CODE> (1,039)
PTNCS

>  <AMOUNT_CURRENT> (1,039)
29.2

$$$$
WAY-345339
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
 12  3  1  0  0  0  0
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  8  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,040)
1040

>  <Formula> (1,040)
C14H12ClNO4

>  <MolWeight> (1,040)
293.70238

>  <PCAT_CMPD_ID> (1,040)
WAY-345339

>  <CNC_ID> (1,040)
359320611

>  <transfer_container_id> (1,040)
PTN000000065

>  <COMPOUND_NUMBER> (1,040)
WAY-345339

>  <BAR_CODE_NO> (1,040)
2555656

>  <LOCATION_CODE> (1,040)
PTNCS

>  <AMOUNT_CURRENT> (1,040)
32.1

$$$$
WAY-343684
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,041)
1041

>  <Formula> (1,041)
C20H19NO5

>  <MolWeight> (1,041)
353.36856

>  <PCAT_CMPD_ID> (1,041)
WAY-343684

>  <CNC_ID> (1,041)
359319026

>  <transfer_container_id> (1,041)
PTN000000065

>  <COMPOUND_NUMBER> (1,041)
WAY-343684

>  <BAR_CODE_NO> (1,041)
2553825

>  <LOCATION_CODE> (1,041)
PTNCS

>  <AMOUNT_CURRENT> (1,041)
29.6

$$$$
WAY-310983
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (1,042)
1042

>  <Formula> (1,042)
C13H14N2OS

>  <MolWeight> (1,042)
246.32806

>  <PCAT_CMPD_ID> (1,042)
WAY-310983

>  <CNC_ID> (1,042)
359314725

>  <transfer_container_id> (1,042)
PTN000000065

>  <COMPOUND_NUMBER> (1,042)
WAY-310983

>  <BAR_CODE_NO> (1,042)
3915301

>  <LOCATION_CODE> (1,042)
PTNCS

>  <AMOUNT_CURRENT> (1,042)
33.3

$$$$
WAY-115431
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 15  2  0  0  0  0
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 22 23  1  0  0  0  0
  5 10  1  0  0  0  0
 12 15  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,043)
1043

>  <Formula> (1,043)
C14H12ClN3O4S

>  <MolWeight> (1,043)
353.78078

>  <PCAT_CMPD_ID> (1,043)
WAY-115431

>  <CNC_ID> (1,043)
359326819

>  <transfer_container_id> (1,043)
PTN000000067

>  <COMPOUND_NUMBER> (1,043)
WAY-115431

>  <BAR_CODE_NO> (1,043)
3918154

>  <LOCATION_CODE> (1,043)
PTNCS

>  <AMOUNT_CURRENT> (1,043)
33.4

$$$$
CL-243214
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  9  1  0  0  0  0
 12  9  2  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15  4  2  0  0  0  0
 16  6  2  0  0  0  0
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 18 17  2  0  0  0  0
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 13 14  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,044)
1044

>  <Formula> (1,044)
C13H10N2O2S

>  <MolWeight> (1,044)
258.2957

>  <PCAT_CMPD_ID> (1,044)
CL-243214

>  <CNC_ID> (1,044)
359313566

>  <transfer_container_id> (1,044)
PTN000000065

>  <COMPOUND_NUMBER> (1,044)
CL-243214

>  <BAR_CODE_NO> (1,044)
2555628

>  <LOCATION_CODE> (1,044)
PTNCS

>  <AMOUNT_CURRENT> (1,044)
32.3

$$$$
WAY-345073
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  3  2  0  0  0  0
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 25 15  2  0  0  0  0
  9  8  1  0  0  0  0
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 19 16  1  0  0  0  0
 17 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,045)
1045

>  <Formula> (1,045)
C19H12F2N2OS

>  <MolWeight> (1,045)
354.3731864

>  <PCAT_CMPD_ID> (1,045)
WAY-345073

>  <CNC_ID> (1,045)
359320383

>  <transfer_container_id> (1,045)
PTN000000065

>  <COMPOUND_NUMBER> (1,045)
WAY-345073

>  <BAR_CODE_NO> (1,045)
2555394

>  <LOCATION_CODE> (1,045)
PTNCS

>  <AMOUNT_CURRENT> (1,045)
32.9

$$$$
WAY-227884
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 18  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,046)
1046

>  <Formula> (1,046)
C13H13NO5

>  <MolWeight> (1,046)
263.24602

>  <PCAT_CMPD_ID> (1,046)
WAY-227884

>  <CNC_ID> (1,046)
359313876

>  <transfer_container_id> (1,046)
PTN000000065

>  <COMPOUND_NUMBER> (1,046)
WAY-227884

>  <BAR_CODE_NO> (1,046)
3915175

>  <LOCATION_CODE> (1,046)
PTNCS

>  <AMOUNT_CURRENT> (1,046)
33.6

$$$$
WAY-312453
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
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M  END
>  <Mol_ID> (1,047)
1047

>  <Formula> (1,047)
C18H17ClF3NO2

>  <MolWeight> (1,047)
371.7812896

>  <PCAT_CMPD_ID> (1,047)
WAY-312453

>  <CNC_ID> (1,047)
359316193

>  <transfer_container_id> (1,047)
PTN000000065

>  <COMPOUND_NUMBER> (1,047)
WAY-312453

>  <BAR_CODE_NO> (1,047)
3917090

>  <LOCATION_CODE> (1,047)
PTNCS

>  <AMOUNT_CURRENT> (1,047)
33.8

$$$$
WAY-310954
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
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 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
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  8 12  1  0  0  0  0
 10 11  1  0  0  0  0
 16 18  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,048)
1048

>  <Formula> (1,048)
C19H14N2O4S

>  <MolWeight> (1,048)
366.39046

>  <PCAT_CMPD_ID> (1,048)
WAY-310954

>  <CNC_ID> (1,048)
359314696

>  <transfer_container_id> (1,048)
PTN000000065

>  <COMPOUND_NUMBER> (1,048)
WAY-310954

>  <BAR_CODE_NO> (1,048)
3915267

>  <LOCATION_CODE> (1,048)
PTNCS

>  <AMOUNT_CURRENT> (1,048)
33.5

$$$$
WAY-311472
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
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 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  9 11  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,049)
1049

>  <Formula> (1,049)
C17H20N2O3

>  <MolWeight> (1,049)
300.3523

>  <PCAT_CMPD_ID> (1,049)
WAY-311472

>  <CNC_ID> (1,049)
359315213

>  <transfer_container_id> (1,049)
PTN000000065

>  <COMPOUND_NUMBER> (1,049)
WAY-311472

>  <BAR_CODE_NO> (1,049)
3915861

>  <LOCATION_CODE> (1,049)
PTNCS

>  <AMOUNT_CURRENT> (1,049)
33.2

$$$$
WAY-311112
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
  9 11  1  0  0  0  0
 15 16  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,050)
1050

>  <Formula> (1,050)
C13H13FN2O2S2

>  <MolWeight> (1,050)
312.3829232

>  <PCAT_CMPD_ID> (1,050)
WAY-311112

>  <CNC_ID> (1,050)
359314853

>  <transfer_container_id> (1,050)
PTN000000065

>  <COMPOUND_NUMBER> (1,050)
WAY-311112

>  <BAR_CODE_NO> (1,050)
3915461

>  <LOCATION_CODE> (1,050)
PTNCS

>  <AMOUNT_CURRENT> (1,050)
33.7

$$$$
GI-574354
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.2139   -1.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 19 23  1  0  0  0  0
  8 11  1  0  0  0  0
 20 23  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,051)
1333

>  <Formula> (1,051)
C17H13N3O2S

>  <MolWeight> (1,051)
323.36902

>  <PCAT_CMPD_ID> (1,051)
GI-574354

>  <CNC_ID> (1,051)
359340000

>  <transfer_container_id> (1,051)
PTN000000068

>  <COMPOUND_NUMBER> (1,051)
GI-574354

>  <BAR_CODE_NO> (1,051)
3897435

>  <LOCATION_CODE> (1,051)
PTNCS

>  <AMOUNT_CURRENT> (1,051)
33.2

$$$$
WAY-113826
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,052)
1334

>  <Formula> (1,052)
C13H18N2O4S

>  <MolWeight> (1,052)
298.35802

>  <PCAT_CMPD_ID> (1,052)
WAY-113826

>  <CNC_ID> (1,052)
359340028

>  <transfer_container_id> (1,052)
PTN000000068

>  <COMPOUND_NUMBER> (1,052)
WAY-113826

>  <BAR_CODE_NO> (1,052)
3898285

>  <LOCATION_CODE> (1,052)
PTNCS

>  <AMOUNT_CURRENT> (1,052)
33.1

$$$$
WAY-115178
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,053)
1335

>  <Formula> (1,053)
C19H26O4

>  <MolWeight> (1,053)
318.40734

>  <PCAT_CMPD_ID> (1,053)
WAY-115178

>  <CNC_ID> (1,053)
359340041

>  <transfer_container_id> (1,053)
PRL000000078

>  <COMPOUND_NUMBER> (1,053)
WAY-115178

>  <BAR_CODE_NO> (1,053)
3928945

>  <LOCATION_CODE> (1,053)
PRLCS

>  <AMOUNT_CURRENT> (1,053)
33.1

$$$$
WAY-117472
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 18 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,054)
1336

>  <Formula> (1,054)
C18H19NO2

>  <MolWeight> (1,054)
281.34896

>  <PCAT_CMPD_ID> (1,054)
WAY-117472

>  <CNC_ID> (1,054)
359340072

>  <transfer_container_id> (1,054)
PTN000000068

>  <COMPOUND_NUMBER> (1,054)
WAY-117472

>  <BAR_CODE_NO> (1,054)
3898679

>  <LOCATION_CODE> (1,054)
PTNCS

>  <AMOUNT_CURRENT> (1,054)
33.3

$$$$
WAY-117476
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,055)
1337

>  <Formula> (1,055)
C19H21NO2

>  <MolWeight> (1,055)
295.37554

>  <PCAT_CMPD_ID> (1,055)
WAY-117476

>  <CNC_ID> (1,055)
359340073

>  <transfer_container_id> (1,055)
PTN000000068

>  <COMPOUND_NUMBER> (1,055)
WAY-117476

>  <BAR_CODE_NO> (1,055)
3898680

>  <LOCATION_CODE> (1,055)
PTNCS

>  <AMOUNT_CURRENT> (1,055)
33.1

$$$$
WAY-117823
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,056)
1338

>  <Formula> (1,056)
C16H14N2O2

>  <MolWeight> (1,056)
266.29456

>  <PCAT_CMPD_ID> (1,056)
WAY-117823

>  <CNC_ID> (1,056)
359340078

>  <transfer_container_id> (1,056)
PTN000000068

>  <COMPOUND_NUMBER> (1,056)
WAY-117823

>  <BAR_CODE_NO> (1,056)
3897545

>  <LOCATION_CODE> (1,056)
PTNCS

>  <AMOUNT_CURRENT> (1,056)
33.3

$$$$
WAY-118304
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
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 10 14  2  0  0  0  0
 10 15  1  0  0  0  0
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,057)
1339

>  <Formula> (1,057)
C17H17NO

>  <MolWeight> (1,057)
251.32298

>  <PCAT_CMPD_ID> (1,057)
WAY-118304

>  <CNC_ID> (1,057)
359340088

>  <transfer_container_id> (1,057)
PTN000000068

>  <COMPOUND_NUMBER> (1,057)
WAY-118304

>  <BAR_CODE_NO> (1,057)
3897611

>  <LOCATION_CODE> (1,057)
PTNCS

>  <AMOUNT_CURRENT> (1,057)
33.5

$$$$
WAY-118442
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
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 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  8 11  2  0  0  0  0
 14 17  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,058)
1340

>  <Formula> (1,058)
C18H20N2O5

>  <MolWeight> (1,058)
344.3618

>  <PCAT_CMPD_ID> (1,058)
WAY-118442

>  <CNC_ID> (1,058)
359340091

>  <transfer_container_id> (1,058)
PTN000000068

>  <COMPOUND_NUMBER> (1,058)
WAY-118442

>  <BAR_CODE_NO> (1,058)
3898345

>  <LOCATION_CODE> (1,058)
PTNCS

>  <AMOUNT_CURRENT> (1,058)
33.2

$$$$
WAY-118455
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 22 24  1  0  0  0  0
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 17 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,059)
1341

>  <Formula> (1,059)
C18H20N2O4S

>  <MolWeight> (1,059)
360.4274

>  <PCAT_CMPD_ID> (1,059)
WAY-118455

>  <CNC_ID> (1,059)
359340094

>  <transfer_container_id> (1,059)
PTN000000068

>  <COMPOUND_NUMBER> (1,059)
WAY-118455

>  <BAR_CODE_NO> (1,059)
3898266

>  <LOCATION_CODE> (1,059)
PTNCS

>  <AMOUNT_CURRENT> (1,059)
33

$$$$
WAY-118927
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11  9  2  0  0  0  0
 12  9  1  0  0  0  0
 13 12  2  0  0  0  0
 14 11  1  0  0  0  0
 15 17  2  0  0  0  0
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 17  7  1  0  0  0  0
 18  7  2  0  0  0  0
 19 10  1  0  0  0  0
  4  5  1  0  0  0  0
 15  8  1  0  0  0  0
 10 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,060)
1342

>  <Formula> (1,060)
C15H13N3S

>  <MolWeight> (1,060)
267.34882

>  <PCAT_CMPD_ID> (1,060)
WAY-118927

>  <CNC_ID> (1,060)
359340106

>  <transfer_container_id> (1,060)
PTN000000068

>  <COMPOUND_NUMBER> (1,060)
WAY-118927

>  <BAR_CODE_NO> (1,060)
3897412

>  <LOCATION_CODE> (1,060)
PTNCS

>  <AMOUNT_CURRENT> (1,060)
33.5

$$$$
WAY-118973-A
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  4  1  0  0  0  0
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 13  9  2  0  0  0  0
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 15  8  1  0  0  0  0
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 17 20  1  0  0  0  0
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 21  6  1  0  0  0  0
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  5  4  2  0  0  0  0
 12  8  1  0  0  0  0
 11 14  2  0  0  0  0
 24 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,061)
1343

>  <Formula> (1,061)
C20H19N5OS

>  <MolWeight> (1,061)
377.46276

>  <PCAT_CMPD_ID> (1,061)
WAY-118973-A

>  <CNC_ID> (1,061)
359340107

>  <transfer_container_id> (1,061)
PTN000000068

>  <COMPOUND_NUMBER> (1,061)
WAY-118973-A

>  <BAR_CODE_NO> (1,061)
3898610

>  <LOCATION_CODE> (1,061)
PTNCS

>  <AMOUNT_CURRENT> (1,061)
33.3

$$$$
WAY-119944
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,062)
1344

>  <Formula> (1,062)
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>  <MolWeight> (1,062)
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WAY-119944

>  <CNC_ID> (1,062)
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>  <transfer_container_id> (1,062)
PTN000000068

>  <COMPOUND_NUMBER> (1,062)
WAY-119944

>  <BAR_CODE_NO> (1,062)
3898819

>  <LOCATION_CODE> (1,062)
PTNCS

>  <AMOUNT_CURRENT> (1,062)
33.5

$$$$
WAY-220526
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,063)
1345

>  <Formula> (1,063)
C12H16N2OS

>  <MolWeight> (1,063)
236.33324

>  <PCAT_CMPD_ID> (1,063)
WAY-220526

>  <CNC_ID> (1,063)
359340153

>  <transfer_container_id> (1,063)
PTN000000068

>  <COMPOUND_NUMBER> (1,063)
WAY-220526

>  <BAR_CODE_NO> (1,063)
3899220

>  <LOCATION_CODE> (1,063)
PTNCS

>  <AMOUNT_CURRENT> (1,063)
33.3

$$$$
WAY-223321
csChFnd80/10111816222D

 10 10  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,064)
1346

>  <Formula> (1,064)
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>  <MolWeight> (1,064)
159.1664

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>  <BAR_CODE_NO> (1,064)
3899222

>  <LOCATION_CODE> (1,064)
PTNCS

>  <AMOUNT_CURRENT> (1,064)
33.5

$$$$
WAY-224162
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,065)
1347

>  <Formula> (1,065)
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>  <MolWeight> (1,065)
223.31134

>  <PCAT_CMPD_ID> (1,065)
WAY-224162

>  <CNC_ID> (1,065)
359340170

>  <transfer_container_id> (1,065)
PTN000000068

>  <COMPOUND_NUMBER> (1,065)
WAY-224162

>  <BAR_CODE_NO> (1,065)
3898348

>  <LOCATION_CODE> (1,065)
PTNCS

>  <AMOUNT_CURRENT> (1,065)
33.5

$$$$
WAY-225422
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,066)
1348

>  <Formula> (1,066)
C15H17N3O3S2

>  <MolWeight> (1,066)
351.44378

>  <PCAT_CMPD_ID> (1,066)
WAY-225422

>  <CNC_ID> (1,066)
359340177

>  <transfer_container_id> (1,066)
PTN000000068

>  <COMPOUND_NUMBER> (1,066)
WAY-225422

>  <BAR_CODE_NO> (1,066)
3898728

>  <LOCATION_CODE> (1,066)
PTNCS

>  <AMOUNT_CURRENT> (1,066)
33

$$$$
WAY-225460
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,067)
1349

>  <Formula> (1,067)
C20H23N3O3

>  <MolWeight> (1,067)
353.41492

>  <PCAT_CMPD_ID> (1,067)
WAY-225460

>  <CNC_ID> (1,067)
359340179

>  <transfer_container_id> (1,067)
PTN000000068

>  <COMPOUND_NUMBER> (1,067)
WAY-225460

>  <BAR_CODE_NO> (1,067)
3898965

>  <LOCATION_CODE> (1,067)
PTNCS

>  <AMOUNT_CURRENT> (1,067)
33.1

$$$$
WAY-225472
csChFnd80/10111816222D

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 11  1  2  0  0  0  0
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 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
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  7  4  1  0  0  0  0
 18 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,068)
1350

>  <Formula> (1,068)
C15H15FN2O4S2

>  <MolWeight> (1,068)
370.4190032

>  <PCAT_CMPD_ID> (1,068)
WAY-225472

>  <CNC_ID> (1,068)
359340180

>  <transfer_container_id> (1,068)
PTN000000068

>  <COMPOUND_NUMBER> (1,068)
WAY-225472

>  <BAR_CODE_NO> (1,068)
3898357

>  <LOCATION_CODE> (1,068)
PTNCS

>  <AMOUNT_CURRENT> (1,068)
33.2

$$$$
WAY-227320
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 20 21  1  0  0  0  0
  5  7  1  0  0  0  0
 12 14  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,069)
1351

>  <Formula> (1,069)
C17H19NO3

>  <MolWeight> (1,069)
285.33766

>  <PCAT_CMPD_ID> (1,069)
WAY-227320

>  <CNC_ID> (1,069)
359340196

>  <transfer_container_id> (1,069)
PTN000000068

>  <COMPOUND_NUMBER> (1,069)
WAY-227320

>  <BAR_CODE_NO> (1,069)
3897967

>  <LOCATION_CODE> (1,069)
PTNCS

>  <AMOUNT_CURRENT> (1,069)
33.4

$$$$
WAY-227469
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,070)
1352

>  <Formula> (1,070)
C11H9ClN2O2S

>  <MolWeight> (1,070)
268.71936

>  <PCAT_CMPD_ID> (1,070)
WAY-227469

>  <CNC_ID> (1,070)
359340198

>  <transfer_container_id> (1,070)
PTN000000068

>  <COMPOUND_NUMBER> (1,070)
WAY-227469

>  <BAR_CODE_NO> (1,070)
3899257

>  <LOCATION_CODE> (1,070)
PTNCS

>  <AMOUNT_CURRENT> (1,070)
33.1

$$$$
WAY-227722
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  4  1  0  0  0  0
 12  3  2  0  0  0  0
 13  6  1  0  0  0  0
 14 10  1  0  0  0  0
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 17  6  2  0  0  0  0
 18  8  1  0  0  0  0
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 22 17  1  0  0  0  0
 23 22  2  0  0  0  0
  7  5  1  0  0  0  0
  9 14  1  0  0  0  0
 23 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,071)
1353

>  <Formula> (1,071)
C17H19ClN2O3

>  <MolWeight> (1,071)
334.79736

>  <PCAT_CMPD_ID> (1,071)
WAY-227722

>  <CNC_ID> (1,071)
359340200

>  <transfer_container_id> (1,071)
PTN000000068

>  <COMPOUND_NUMBER> (1,071)
WAY-227722

>  <BAR_CODE_NO> (1,071)
3897240

>  <LOCATION_CODE> (1,071)
PTNCS

>  <AMOUNT_CURRENT> (1,071)
33.5

$$$$
WAY-229410
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  3  2  0  0  0  0
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 13  9  2  0  0  0  0
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 15  8  2  0  0  0  0
 14 16  2  0  0  0  0
 17 15  1  0  0  0  0
 18  9  1  0  0  0  0
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 20  5  1  0  0  0  0
 21  6  1  0  0  0  0
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 21 23  2  0  0  0  0
 25 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,072)
1354

>  <Formula> (1,072)
C21H13NO4

>  <MolWeight> (1,072)
343.33222

>  <PCAT_CMPD_ID> (1,072)
WAY-229410

>  <CNC_ID> (1,072)
359340206

>  <transfer_container_id> (1,072)
PTN000000068

>  <COMPOUND_NUMBER> (1,072)
WAY-229410

>  <BAR_CODE_NO> (1,072)
3897396

>  <LOCATION_CODE> (1,072)
PTNCS

>  <AMOUNT_CURRENT> (1,072)
33.3

$$$$
WAY-230289
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
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 11 12  1  0  0  0  0
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M  END
>  <Mol_ID> (1,073)
1355

>  <Formula> (1,073)
C17H16ClNO4S

>  <MolWeight> (1,073)
365.83124

>  <PCAT_CMPD_ID> (1,073)
WAY-230289

>  <CNC_ID> (1,073)
359340213

>  <transfer_container_id> (1,073)
PTN000000068

>  <COMPOUND_NUMBER> (1,073)
WAY-230289

>  <BAR_CODE_NO> (1,073)
3898909

>  <LOCATION_CODE> (1,073)
PTNCS

>  <AMOUNT_CURRENT> (1,073)
33.3

$$$$
WAY-230798-B
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  3  1  0  0  0  0
 13 11  1  0  0  0  0
 14  6  1  0  0  0  0
 15 12  2  0  0  0  0
 16 15  1  0  0  0  0
 17 13  2  0  0  0  0
 18  5  1  0  0  0  0
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 20 13  1  0  0  0  0
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 22 19  1  0  0  0  0
 23 20  2  0  0  0  0
 24 23  1  0  0  0  0
  4  6  2  0  0  0  0
  8 10  1  0  0  0  0
 14 16  2  0  0  0  0
 21 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,074)
1356

>  <Formula> (1,074)
C18H16N4OS

>  <MolWeight> (1,074)
336.41084

>  <PCAT_CMPD_ID> (1,074)
WAY-230798-B

>  <CNC_ID> (1,074)
359340218

>  <transfer_container_id> (1,074)
PTN000000068

>  <COMPOUND_NUMBER> (1,074)
WAY-230798-B

>  <BAR_CODE_NO> (1,074)
3899261

>  <LOCATION_CODE> (1,074)
PTNCS

>  <AMOUNT_CURRENT> (1,074)
33.5

$$$$
WAY-233292
csChFnd80/10111816222D

 23 27  0  0  0  0  0  0  0  0999 V2000
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  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 13  1  0  0  0  0
 15 19  1  0  0  0  0
 17 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,075)
1357

>  <Formula> (1,075)
C19H23N3O

>  <MolWeight> (1,075)
309.40542

>  <PCAT_CMPD_ID> (1,075)
WAY-233292

>  <CNC_ID> (1,075)
359340258

>  <transfer_container_id> (1,075)
PTN000000068

>  <COMPOUND_NUMBER> (1,075)
WAY-233292

>  <BAR_CODE_NO> (1,075)
3897580

>  <LOCATION_CODE> (1,075)
PTNCS

>  <AMOUNT_CURRENT> (1,075)
33.4

$$$$
WAY-234609-B
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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  5  9  2  0  0  0  0
  6  7  2  0  0  0  0
 14 18  1  0  0  0  0
 20 22  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,076)
1358

>  <Formula> (1,076)
C23H26N4O2

>  <MolWeight> (1,076)
390.47814

>  <PCAT_CMPD_ID> (1,076)
WAY-234609-B

>  <CNC_ID> (1,076)
359340273

>  <transfer_container_id> (1,076)
PTN000000068

>  <COMPOUND_NUMBER> (1,076)
WAY-234609-B

>  <BAR_CODE_NO> (1,076)
3899270

>  <LOCATION_CODE> (1,076)
PTNCS

>  <AMOUNT_CURRENT> (1,076)
33.4

$$$$
WAY-234624-A
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  4  5  1  0  0  0  0
 20 14  1  0  0  0  0
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 16 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,077)
1359

>  <Formula> (1,077)
C20H21N3O

>  <MolWeight> (1,077)
319.40024

>  <PCAT_CMPD_ID> (1,077)
WAY-234624-A

>  <CNC_ID> (1,077)
359340274

>  <transfer_container_id> (1,077)
PTN000000068

>  <COMPOUND_NUMBER> (1,077)
WAY-234624-A

>  <BAR_CODE_NO> (1,077)
3897290

>  <LOCATION_CODE> (1,077)
PTNCS

>  <AMOUNT_CURRENT> (1,077)
33.3

$$$$
WAY-235289
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,078)
1360

>  <Formula> (1,078)
C21H15BrN2O3S

>  <MolWeight> (1,078)
455.3244

>  <PCAT_CMPD_ID> (1,078)
WAY-235289

>  <CNC_ID> (1,078)
359340283

>  <transfer_container_id> (1,078)
PTN000000068

>  <COMPOUND_NUMBER> (1,078)
WAY-235289

>  <BAR_CODE_NO> (1,078)
3898196

>  <LOCATION_CODE> (1,078)
PTNCS

>  <AMOUNT_CURRENT> (1,078)
33.4

$$$$
WAY-236238
csChFnd80/10111816222D

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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 21 23  1  0  0  0  0
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 12 13  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,079)
1361

>  <Formula> (1,079)
C17H18N2O4

>  <MolWeight> (1,079)
314.33582

>  <PCAT_CMPD_ID> (1,079)
WAY-236238

>  <CNC_ID> (1,079)
359340293

>  <transfer_container_id> (1,079)
PTN000000068

>  <COMPOUND_NUMBER> (1,079)
WAY-236238

>  <BAR_CODE_NO> (1,079)
3897303

>  <LOCATION_CODE> (1,079)
PTNCS

>  <AMOUNT_CURRENT> (1,079)
33.2

$$$$
WAY-236338-A
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  1  2  0  0  0  0
 12  2  2  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15  6  2  0  0  0  0
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 22  5  2  0  0  0  0
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M  END
>  <Mol_ID> (1,080)
1362

>  <Formula> (1,080)
C22H21N3O3

>  <MolWeight> (1,080)
375.42044

>  <PCAT_CMPD_ID> (1,080)
WAY-236338-A

>  <CNC_ID> (1,080)
359340296

>  <transfer_container_id> (1,080)
PTN000000068

>  <COMPOUND_NUMBER> (1,080)
WAY-236338-A

>  <BAR_CODE_NO> (1,080)
3897319

>  <LOCATION_CODE> (1,080)
PTNCS

>  <AMOUNT_CURRENT> (1,080)
33.3

$$$$
WAY-236740
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  3  2  0  0  0  0
 12  2  1  0  0  0  0
 13  2  2  0  0  0  0
 14  6  2  0  0  0  0
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M  END
>  <Mol_ID> (1,081)
1363

>  <Formula> (1,081)
C20H13N3O5S

>  <MolWeight> (1,081)
407.39932

>  <PCAT_CMPD_ID> (1,081)
WAY-236740

>  <CNC_ID> (1,081)
359340302

>  <transfer_container_id> (1,081)
PTN000000068

>  <COMPOUND_NUMBER> (1,081)
WAY-236740

>  <BAR_CODE_NO> (1,081)
3898750

>  <LOCATION_CODE> (1,081)
PTNCS

>  <AMOUNT_CURRENT> (1,081)
33.4

$$$$
WAY-237008
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,082)
1364

>  <Formula> (1,082)
C13H12ClNO3

>  <MolWeight> (1,082)
265.69228

>  <PCAT_CMPD_ID> (1,082)
WAY-237008

>  <CNC_ID> (1,082)
359340305

>  <transfer_container_id> (1,082)
PTN000000068

>  <COMPOUND_NUMBER> (1,082)
WAY-237008

>  <BAR_CODE_NO> (1,082)
3898153

>  <LOCATION_CODE> (1,082)
PTNCS

>  <AMOUNT_CURRENT> (1,082)
33.5

$$$$
WAY-296510
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 13 16  1  0  0  0  0
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  7  9  1  0  0  0  0
 12 14  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,083)
1365

>  <Formula> (1,083)
C17H11F3N2O4S

>  <MolWeight> (1,083)
396.3404496

>  <PCAT_CMPD_ID> (1,083)
WAY-296510

>  <CNC_ID> (1,083)
359342954

>  <transfer_container_id> (1,083)
PTN000000068

>  <COMPOUND_NUMBER> (1,083)
WAY-296510

>  <BAR_CODE_NO> (1,083)
3897322

>  <LOCATION_CODE> (1,083)
PTNCS

>  <AMOUNT_CURRENT> (1,083)
33.5

$$$$
WAY-296511
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   -1.2414    0.7103    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4 10  2  0  0  0  0
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 11 14  1  0  0  0  0
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 16 20  2  0  0  0  0
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 20 22  1  0  0  0  0
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 22 24  2  0  0  0  0
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 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 28 30  1  0  0  0  0
  7  9  1  0  0  0  0
 12 14  2  0  0  0  0
 23 24  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (1,084)
1366

>  <Formula> (1,084)
C21H20F3N3O3

>  <MolWeight> (1,084)
419.3970096

>  <PCAT_CMPD_ID> (1,084)
WAY-296511

>  <CNC_ID> (1,084)
359342955

>  <transfer_container_id> (1,084)
PTN000000068

>  <COMPOUND_NUMBER> (1,084)
WAY-296511

>  <BAR_CODE_NO> (1,084)
3897323

>  <LOCATION_CODE> (1,084)
PTNCS

>  <AMOUNT_CURRENT> (1,084)
33.3

$$$$
WAY-296515
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  2  2  0  0  0  0
 14  2  2  0  0  0  0
 15 12  2  0  0  0  0
 16  8  2  0  0  0  0
 17  8  1  0  0  0  0
 18  9  2  0  0  0  0
 19 20  2  0  0  0  0
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  6  7  2  0  0  0  0
 26 29  1  0  0  0  0
 19 15  1  0  0  0  0
 28 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,085)
1367

>  <Formula> (1,085)
C21H17N3O3S2

>  <MolWeight> (1,085)
423.50798

>  <PCAT_CMPD_ID> (1,085)
WAY-296515

>  <CNC_ID> (1,085)
359342959

>  <transfer_container_id> (1,085)
PTN000000068

>  <COMPOUND_NUMBER> (1,085)
WAY-296515

>  <BAR_CODE_NO> (1,085)
3897328

>  <LOCATION_CODE> (1,085)
PTNCS

>  <AMOUNT_CURRENT> (1,085)
33.1

$$$$
WAY-296524
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 11 12  1  0  0  0  0
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 13 15  2  0  0  0  0
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 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
  6  9  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,086)
1368

>  <Formula> (1,086)
C16H15NO3

>  <MolWeight> (1,086)
269.2952

>  <PCAT_CMPD_ID> (1,086)
WAY-296524

>  <CNC_ID> (1,086)
359342968

>  <transfer_container_id> (1,086)
PTN000000068

>  <COMPOUND_NUMBER> (1,086)
WAY-296524

>  <BAR_CODE_NO> (1,086)
3897340

>  <LOCATION_CODE> (1,086)
PTNCS

>  <AMOUNT_CURRENT> (1,086)
33

$$$$
WAY-296536
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  5  2  0  0  0  0
 11 16  2  0  0  0  0
 12  1  1  0  0  0  0
 13  8  1  0  0  0  0
 14  9  1  0  0  0  0
 15  3  2  0  0  0  0
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 17 22  2  0  0  0  0
 18  9  2  0  0  0  0
 19 13  2  0  0  0  0
 20 14  1  0  0  0  0
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 22 19  1  0  0  0  0
 23 21  2  0  0  0  0
 23 18  1  0  0  0  0
 17 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,087)
1369

>  <Formula> (1,087)
C15H17N3O4S

>  <MolWeight> (1,087)
335.37818

>  <PCAT_CMPD_ID> (1,087)
WAY-296536

>  <CNC_ID> (1,087)
359342980

>  <transfer_container_id> (1,087)
PTN000000068

>  <COMPOUND_NUMBER> (1,087)
WAY-296536

>  <BAR_CODE_NO> (1,087)
3897354

>  <LOCATION_CODE> (1,087)
PTNCS

>  <AMOUNT_CURRENT> (1,087)
33.1

$$$$
WAY-296542
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 12 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 18 19  2  0  0  0  0
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 26 27  1  0  0  0  0
  9 11  2  0  0  0  0
 13 15  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,088)
1370

>  <Formula> (1,088)
C22H20N2O3

>  <MolWeight> (1,088)
360.4058

>  <PCAT_CMPD_ID> (1,088)
WAY-296542

>  <CNC_ID> (1,088)
359342986

>  <transfer_container_id> (1,088)
PTN000000068

>  <COMPOUND_NUMBER> (1,088)
WAY-296542

>  <BAR_CODE_NO> (1,088)
3897364

>  <LOCATION_CODE> (1,088)
PTNCS

>  <AMOUNT_CURRENT> (1,088)
33.2

$$$$
WAY-296545
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
 11  5  2  0  0  0  0
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 13  6  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
  7  8  2  0  0  0  0
 11  9  1  0  0  0  0
M  END
>  <Mol_ID> (1,089)
1371

>  <Formula> (1,089)
C9H12N6

>  <MolWeight> (1,089)
204.23178

>  <PCAT_CMPD_ID> (1,089)
WAY-296545

>  <CNC_ID> (1,089)
359342989

>  <transfer_container_id> (1,089)
PTN000000068

>  <COMPOUND_NUMBER> (1,089)
WAY-296545

>  <BAR_CODE_NO> (1,089)
3897368

>  <LOCATION_CODE> (1,089)
PTNCS

>  <AMOUNT_CURRENT> (1,089)
33.4

$$$$
WAY-296550
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
  9 14  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,090)
1372

>  <Formula> (1,090)
C16H19N3O4S

>  <MolWeight> (1,090)
349.40476

>  <PCAT_CMPD_ID> (1,090)
WAY-296550

>  <CNC_ID> (1,090)
359342994

>  <transfer_container_id> (1,090)
PTN000000068

>  <COMPOUND_NUMBER> (1,090)
WAY-296550

>  <BAR_CODE_NO> (1,090)
3897375

>  <LOCATION_CODE> (1,090)
PTNCS

>  <AMOUNT_CURRENT> (1,090)
33.4

$$$$
WAY-296583-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 18 21  1  0  0  0  0
  7  8  1  0  0  0  0
 10 12  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,091)
1373

>  <Formula> (1,091)
C16H15N3OS

>  <MolWeight> (1,091)
297.3748

>  <PCAT_CMPD_ID> (1,091)
WAY-296583-A

>  <CNC_ID> (1,091)
359343027

>  <transfer_container_id> (1,091)
PTN000000068

>  <COMPOUND_NUMBER> (1,091)
WAY-296583-A

>  <BAR_CODE_NO> (1,091)
3897414

>  <LOCATION_CODE> (1,091)
PTNCS

>  <AMOUNT_CURRENT> (1,091)
33.3

$$$$
WAY-296586
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,092)
1374

>  <Formula> (1,092)
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>  <MolWeight> (1,092)
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>  <CNC_ID> (1,092)
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>  <transfer_container_id> (1,092)
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>  <COMPOUND_NUMBER> (1,092)
WAY-296586

>  <BAR_CODE_NO> (1,092)
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>  <LOCATION_CODE> (1,092)
PTNCS

>  <AMOUNT_CURRENT> (1,092)
33.1

$$$$
WAY-296642
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,093)
1375

>  <Formula> (1,093)
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318.77804

>  <PCAT_CMPD_ID> (1,093)
WAY-296642

>  <CNC_ID> (1,093)
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>  <transfer_container_id> (1,093)
PTN000000068

>  <COMPOUND_NUMBER> (1,093)
WAY-296642

>  <BAR_CODE_NO> (1,093)
3897488

>  <LOCATION_CODE> (1,093)
PTNCS

>  <AMOUNT_CURRENT> (1,093)
33.1

$$$$
WAY-296646
csChFnd80/10111816222D

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>  <Mol_ID> (1,094)
1376

>  <Formula> (1,094)
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>  <MolWeight> (1,094)
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>  <CNC_ID> (1,094)
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>  <COMPOUND_NUMBER> (1,094)
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>  <BAR_CODE_NO> (1,094)
3897494

>  <LOCATION_CODE> (1,094)
PTNCS

>  <AMOUNT_CURRENT> (1,094)
33.3

$$$$
WAY-296649
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,095)
1377

>  <Formula> (1,095)
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>  <MolWeight> (1,095)
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>  <PCAT_CMPD_ID> (1,095)
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>  <CNC_ID> (1,095)
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>  <transfer_container_id> (1,095)
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>  <COMPOUND_NUMBER> (1,095)
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>  <BAR_CODE_NO> (1,095)
3897497

>  <LOCATION_CODE> (1,095)
PTNCS

>  <AMOUNT_CURRENT> (1,095)
33.1

$$$$
WAY-296651
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,096)
1378

>  <Formula> (1,096)
C23H16ClFN2O3

>  <MolWeight> (1,096)
422.8361432

>  <PCAT_CMPD_ID> (1,096)
WAY-296651

>  <CNC_ID> (1,096)
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>  <transfer_container_id> (1,096)
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>  <COMPOUND_NUMBER> (1,096)
WAY-296651

>  <BAR_CODE_NO> (1,096)
3897500

>  <LOCATION_CODE> (1,096)
PTNCS

>  <AMOUNT_CURRENT> (1,096)
33.5

$$$$
WAY-296654
csChFnd80/10111816222D

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>  <Mol_ID> (1,097)
1379

>  <Formula> (1,097)
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>  <MolWeight> (1,097)
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>  <PCAT_CMPD_ID> (1,097)
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>  <CNC_ID> (1,097)
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>  <COMPOUND_NUMBER> (1,097)
WAY-296654

>  <BAR_CODE_NO> (1,097)
3897503

>  <LOCATION_CODE> (1,097)
PTNCS

>  <AMOUNT_CURRENT> (1,097)
33.2

$$$$
WAY-296661
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,098)
1380

>  <Formula> (1,098)
C17H26N2O4

>  <MolWeight> (1,098)
322.39934

>  <PCAT_CMPD_ID> (1,098)
WAY-296661

>  <CNC_ID> (1,098)
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>  <transfer_container_id> (1,098)
PTN000000068

>  <COMPOUND_NUMBER> (1,098)
WAY-296661

>  <BAR_CODE_NO> (1,098)
3897510

>  <LOCATION_CODE> (1,098)
PTNCS

>  <AMOUNT_CURRENT> (1,098)
33

$$$$
WAY-296670
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,099)
1381

>  <Formula> (1,099)
C23H21N3O2

>  <MolWeight> (1,099)
371.43174

>  <PCAT_CMPD_ID> (1,099)
WAY-296670

>  <CNC_ID> (1,099)
359343114

>  <transfer_container_id> (1,099)
PTN000000068

>  <COMPOUND_NUMBER> (1,099)
WAY-296670

>  <BAR_CODE_NO> (1,099)
3897523

>  <LOCATION_CODE> (1,099)
PTNCS

>  <AMOUNT_CURRENT> (1,099)
33

$$$$
WAY-296716
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,100)
1382

>  <Formula> (1,100)
C15H16N2O2S

>  <MolWeight> (1,100)
288.36474

>  <PCAT_CMPD_ID> (1,100)
WAY-296716

>  <CNC_ID> (1,100)
359343160

>  <transfer_container_id> (1,100)
PTN000000068

>  <COMPOUND_NUMBER> (1,100)
WAY-296716

>  <BAR_CODE_NO> (1,100)
3897582

>  <LOCATION_CODE> (1,100)
PTNCS

>  <AMOUNT_CURRENT> (1,100)
33.2

$$$$
WAY-296724
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,101)
1383

>  <Formula> (1,101)
C12H10Cl2N2O2S

>  <MolWeight> (1,101)
317.191

>  <PCAT_CMPD_ID> (1,101)
WAY-296724

>  <CNC_ID> (1,101)
359343168

>  <transfer_container_id> (1,101)
PTN000000068

>  <COMPOUND_NUMBER> (1,101)
WAY-296724

>  <BAR_CODE_NO> (1,101)
3897595

>  <LOCATION_CODE> (1,101)
PTNCS

>  <AMOUNT_CURRENT> (1,101)
33.1

$$$$
WAY-296737
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,102)
1384

>  <Formula> (1,102)
C16H10N2O2S

>  <MolWeight> (1,102)
294.3278

>  <PCAT_CMPD_ID> (1,102)
WAY-296737

>  <CNC_ID> (1,102)
359343181

>  <transfer_container_id> (1,102)
PTN000000068

>  <COMPOUND_NUMBER> (1,102)
WAY-296737

>  <BAR_CODE_NO> (1,102)
3897613

>  <LOCATION_CODE> (1,102)
PTNCS

>  <AMOUNT_CURRENT> (1,102)
33.5

$$$$
WAY-296740
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  7 12  2  0  0  0  0
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 10 15  1  0  0  0  0
 10 16  2  0  0  0  0
 12 17  1  0  0  0  0
 15 18  2  0  0  0  0
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 18 20  1  0  0  0  0
  6  9  1  0  0  0  0
 13 17  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,103)
1385

>  <Formula> (1,103)
C17H17NOS

>  <MolWeight> (1,103)
283.38798

>  <PCAT_CMPD_ID> (1,103)
WAY-296740

>  <CNC_ID> (1,103)
359343184

>  <transfer_container_id> (1,103)
PTN000000068

>  <COMPOUND_NUMBER> (1,103)
WAY-296740

>  <BAR_CODE_NO> (1,103)
3897617

>  <LOCATION_CODE> (1,103)
PTNCS

>  <AMOUNT_CURRENT> (1,103)
33.3

$$$$
WAY-296754
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  3  1  0  0  0  0
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  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  5 12  2  0  0  0  0
  8 13  2  0  0  0  0
  8 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  2  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 18 23  2  0  0  0  0
  6 10  1  0  0  0  0
 17 22  2  0  0  0  0
 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,104)
1386

>  <Formula> (1,104)
C18H18N2O3

>  <MolWeight> (1,104)
310.34712

>  <PCAT_CMPD_ID> (1,104)
WAY-296754

>  <CNC_ID> (1,104)
359343198

>  <transfer_container_id> (1,104)
PTN000000068

>  <COMPOUND_NUMBER> (1,104)
WAY-296754

>  <BAR_CODE_NO> (1,104)
3897633

>  <LOCATION_CODE> (1,104)
PTNCS

>  <AMOUNT_CURRENT> (1,104)
33.2

$$$$
WAY-296822-A
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  1  3  1  0  0  0  0
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 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
  5  9  2  0  0  0  0
 12 15  1  0  0  0  0
 13 14  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,105)
1387

>  <Formula> (1,105)
C19H16N4O2S

>  <MolWeight> (1,105)
364.42094

>  <PCAT_CMPD_ID> (1,105)
WAY-296822-A

>  <CNC_ID> (1,105)
359343266

>  <transfer_container_id> (1,105)
PTN000000068

>  <COMPOUND_NUMBER> (1,105)
WAY-296822-A

>  <BAR_CODE_NO> (1,105)
3897715

>  <LOCATION_CODE> (1,105)
PTNCS

>  <AMOUNT_CURRENT> (1,105)
33.3

$$$$
WAY-296823-A
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  4  1  0  0  0  0
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 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 18 20  2  0  0  0  0
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 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,106)
1388

>  <Formula> (1,106)
C18H16N2O4S

>  <MolWeight> (1,106)
356.39564

>  <PCAT_CMPD_ID> (1,106)
WAY-296823-A

>  <CNC_ID> (1,106)
359343267

>  <transfer_container_id> (1,106)
PTN000000068

>  <COMPOUND_NUMBER> (1,106)
WAY-296823-A

>  <BAR_CODE_NO> (1,106)
3897716

>  <LOCATION_CODE> (1,106)
PTNCS

>  <AMOUNT_CURRENT> (1,106)
33.4

$$$$
WAY-296824
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 12 16  2  0  0  0  0
 14 17  1  0  0  0  0
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 17 19  1  0  0  0  0
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 20 22  2  0  0  0  0
 10 11  2  0  0  0  0
 13 16  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,107)
1389

>  <Formula> (1,107)
C15H16N2O4S

>  <MolWeight> (1,107)
320.36354

>  <PCAT_CMPD_ID> (1,107)
WAY-296824

>  <CNC_ID> (1,107)
359343268

>  <transfer_container_id> (1,107)
PTN000000068

>  <COMPOUND_NUMBER> (1,107)
WAY-296824

>  <BAR_CODE_NO> (1,107)
3897717

>  <LOCATION_CODE> (1,107)
PTNCS

>  <AMOUNT_CURRENT> (1,107)
33.4

$$$$
WAY-296836
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,108)
1390

>  <Formula> (1,108)
C14H12BrF3N4O

>  <MolWeight> (1,108)
389.1704896

>  <PCAT_CMPD_ID> (1,108)
WAY-296836

>  <CNC_ID> (1,108)
359343280

>  <transfer_container_id> (1,108)
PTN000000068

>  <COMPOUND_NUMBER> (1,108)
WAY-296836

>  <BAR_CODE_NO> (1,108)
3897734

>  <LOCATION_CODE> (1,108)
PTNCS

>  <AMOUNT_CURRENT> (1,108)
33.1

$$$$
WAY-296843
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
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  6  3  2  0  0  0  0
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  8  1  1  0  0  0  0
  9  1  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  4  1  0  0  0  0
 13  5  1  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 18  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  2  0  0  0  0
 19 16  1  0  0  0  0
 20 12  1  0  0  0  0
 21 12  1  0  0  0  0
 22 13  1  0  0  0  0
 23 13  1  0  0  0  0
 17 16  2  0  0  0  0
  5  2  2  0  0  0  0
M  END
>  <Mol_ID> (1,109)
1391

>  <Formula> (1,109)
C13H17ClN6O2S

>  <MolWeight> (1,109)
356.83108

>  <PCAT_CMPD_ID> (1,109)
WAY-296843

>  <CNC_ID> (1,109)
359343287

>  <transfer_container_id> (1,109)
PTN000000068

>  <COMPOUND_NUMBER> (1,109)
WAY-296843

>  <BAR_CODE_NO> (1,109)
3897742

>  <LOCATION_CODE> (1,109)
PTNCS

>  <AMOUNT_CURRENT> (1,109)
33.2

$$$$
WAY-296867
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  8 14  1  0  0  0  0
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 11 16  2  0  0  0  0
 13 17  1  0  0  0  0
 15 18  2  0  0  0  0
 15 19  1  0  0  0  0
 18 20  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  2  0  0  0  0
 20 21  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,110)
1392

>  <Formula> (1,110)
C21H16N2OS

>  <MolWeight> (1,110)
344.42954

>  <PCAT_CMPD_ID> (1,110)
WAY-296867

>  <CNC_ID> (1,110)
359343311

>  <transfer_container_id> (1,110)
PTN000000068

>  <COMPOUND_NUMBER> (1,110)
WAY-296867

>  <BAR_CODE_NO> (1,110)
3897781

>  <LOCATION_CODE> (1,110)
PTNCS

>  <AMOUNT_CURRENT> (1,110)
33.1

$$$$
WAY-296882
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
 16 20  1  0  0  0  0
 18 19  2  0  0  0  0
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M  END
>  <Mol_ID> (1,111)
1393

>  <Formula> (1,111)
C19H14Cl2N4OS

>  <MolWeight> (1,111)
417.31166

>  <PCAT_CMPD_ID> (1,111)
WAY-296882

>  <CNC_ID> (1,111)
359343326

>  <transfer_container_id> (1,111)
PTN000000068

>  <COMPOUND_NUMBER> (1,111)
WAY-296882

>  <BAR_CODE_NO> (1,111)
3897799

>  <LOCATION_CODE> (1,111)
PTNCS

>  <AMOUNT_CURRENT> (1,111)
33.4

$$$$
WAY-296889
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,112)
1394

>  <Formula> (1,112)
C14H12N2OS2

>  <MolWeight> (1,112)
288.38788

>  <PCAT_CMPD_ID> (1,112)
WAY-296889

>  <CNC_ID> (1,112)
359343333

>  <transfer_container_id> (1,112)
PTN000000068

>  <COMPOUND_NUMBER> (1,112)
WAY-296889

>  <BAR_CODE_NO> (1,112)
3897806

>  <LOCATION_CODE> (1,112)
PTNCS

>  <AMOUNT_CURRENT> (1,112)
33.4

$$$$
WAY-296891
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,113)
1395

>  <Formula> (1,113)
C16H13N3O3

>  <MolWeight> (1,113)
295.29272

>  <PCAT_CMPD_ID> (1,113)
WAY-296891

>  <CNC_ID> (1,113)
359343335

>  <transfer_container_id> (1,113)
PTN000000068

>  <COMPOUND_NUMBER> (1,113)
WAY-296891

>  <BAR_CODE_NO> (1,113)
3897808

>  <LOCATION_CODE> (1,113)
PTNCS

>  <AMOUNT_CURRENT> (1,113)
33.1

$$$$
WAY-296904
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 17  2  0  0  0  0
 10 18  1  0  0  0  0
 11 19  1  0  0  0  0
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  9 12  2  0  0  0  0
 15 21  1  0  0  0  0
 19 23  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,114)
1396

>  <Formula> (1,114)
C21H17N3O

>  <MolWeight> (1,114)
327.37918

>  <PCAT_CMPD_ID> (1,114)
WAY-296904

>  <CNC_ID> (1,114)
359343348

>  <transfer_container_id> (1,114)
PTN000000068

>  <COMPOUND_NUMBER> (1,114)
WAY-296904

>  <BAR_CODE_NO> (1,114)
3897825

>  <LOCATION_CODE> (1,114)
PTNCS

>  <AMOUNT_CURRENT> (1,114)
33.3

$$$$
WAY-296922
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
  5  6  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,115)
1397

>  <Formula> (1,115)
C15H16N2O5S

>  <MolWeight> (1,115)
336.36294

>  <PCAT_CMPD_ID> (1,115)
WAY-296922

>  <CNC_ID> (1,115)
359343366

>  <transfer_container_id> (1,115)
PTN000000068

>  <COMPOUND_NUMBER> (1,115)
WAY-296922

>  <BAR_CODE_NO> (1,115)
3897846

>  <LOCATION_CODE> (1,115)
PTNCS

>  <AMOUNT_CURRENT> (1,115)
33.4

$$$$
WAY-296945-A
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  8 12  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,116)
1398

>  <Formula> (1,116)
C18H28N2O

>  <MolWeight> (1,116)
288.42772

>  <PCAT_CMPD_ID> (1,116)
WAY-296945-A

>  <CNC_ID> (1,116)
359343389

>  <transfer_container_id> (1,116)
PTN000000068

>  <COMPOUND_NUMBER> (1,116)
WAY-296945-A

>  <BAR_CODE_NO> (1,116)
3897875

>  <LOCATION_CODE> (1,116)
PTNCS

>  <AMOUNT_CURRENT> (1,116)
33.3

$$$$
WAY-296952
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 25 26  1  0  0  0  0
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 16 19  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,117)
1399

>  <Formula> (1,117)
C18H18ClFN2O3S

>  <MolWeight> (1,117)
396.8635232

>  <PCAT_CMPD_ID> (1,117)
WAY-296952

>  <CNC_ID> (1,117)
359343396

>  <transfer_container_id> (1,117)
PTN000000068

>  <COMPOUND_NUMBER> (1,117)
WAY-296952

>  <BAR_CODE_NO> (1,117)
3897882

>  <LOCATION_CODE> (1,117)
PTNCS

>  <AMOUNT_CURRENT> (1,117)
33.3

$$$$
WAY-296962
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 14 18  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,118)
1400

>  <Formula> (1,118)
C19H14N2O3

>  <MolWeight> (1,118)
318.32606

>  <PCAT_CMPD_ID> (1,118)
WAY-296962

>  <CNC_ID> (1,118)
359343406

>  <transfer_container_id> (1,118)
PTN000000068

>  <COMPOUND_NUMBER> (1,118)
WAY-296962

>  <BAR_CODE_NO> (1,118)
3897893

>  <LOCATION_CODE> (1,118)
PTNCS

>  <AMOUNT_CURRENT> (1,118)
33.3

$$$$
WAY-296966
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 18 20  2  0  0  0  0
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  5  7  1  0  0  0  0
  9 12  2  0  0  0  0
 16 18  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,119)
1401

>  <Formula> (1,119)
C20H15FN2O2S2

>  <MolWeight> (1,119)
398.4737032

>  <PCAT_CMPD_ID> (1,119)
WAY-296966

>  <CNC_ID> (1,119)
359343410

>  <transfer_container_id> (1,119)
PTN000000068

>  <COMPOUND_NUMBER> (1,119)
WAY-296966

>  <BAR_CODE_NO> (1,119)
3897897

>  <LOCATION_CODE> (1,119)
PTNCS

>  <AMOUNT_CURRENT> (1,119)
33.1

$$$$
WAY-296984
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 16  2  0  0  0  0
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 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
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  5  7  1  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,120)
1402

>  <Formula> (1,120)
C23H24N2O

>  <MolWeight> (1,120)
344.44946

>  <PCAT_CMPD_ID> (1,120)
WAY-296984

>  <CNC_ID> (1,120)
359343428

>  <transfer_container_id> (1,120)
PTN000000068

>  <COMPOUND_NUMBER> (1,120)
WAY-296984

>  <BAR_CODE_NO> (1,120)
3897924

>  <LOCATION_CODE> (1,120)
PTNCS

>  <AMOUNT_CURRENT> (1,120)
33.1

$$$$
WAY-296988
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,121)
1403

>  <Formula> (1,121)
C16H18N2O5S

>  <MolWeight> (1,121)
350.38952

>  <PCAT_CMPD_ID> (1,121)
WAY-296988

>  <CNC_ID> (1,121)
359343432

>  <transfer_container_id> (1,121)
PTN000000068

>  <COMPOUND_NUMBER> (1,121)
WAY-296988

>  <BAR_CODE_NO> (1,121)
3897930

>  <LOCATION_CODE> (1,121)
PTNCS

>  <AMOUNT_CURRENT> (1,121)
33.1

$$$$
WAY-296991
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 15  8  1  0  0  0  0
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  2  5  2  0  0  0  0
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M  END
>  <Mol_ID> (1,122)
1404

>  <Formula> (1,122)
C15H11ClN2O

>  <MolWeight> (1,122)
270.71364

>  <PCAT_CMPD_ID> (1,122)
WAY-296991

>  <CNC_ID> (1,122)
359343435

>  <transfer_container_id> (1,122)
PTN000000068

>  <COMPOUND_NUMBER> (1,122)
WAY-296991

>  <BAR_CODE_NO> (1,122)
3897933

>  <LOCATION_CODE> (1,122)
PTNCS

>  <AMOUNT_CURRENT> (1,122)
33

$$$$
WAY-296992
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  5  9  2  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 16 18  1  0  0  0  0
  8  9  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,123)
1405

>  <Formula> (1,123)
C13H14N2O2S

>  <MolWeight> (1,123)
262.32746

>  <PCAT_CMPD_ID> (1,123)
WAY-296992

>  <CNC_ID> (1,123)
359343436

>  <transfer_container_id> (1,123)
PTN000000068

>  <COMPOUND_NUMBER> (1,123)
WAY-296992

>  <BAR_CODE_NO> (1,123)
3897934

>  <LOCATION_CODE> (1,123)
PTNCS

>  <AMOUNT_CURRENT> (1,123)
33.2

$$$$
WAY-296993
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  3  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  5  7  1  0  0  0  0
  9 12  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,124)
1406

>  <Formula> (1,124)
C19H20N2O3S

>  <MolWeight> (1,124)
356.4387

>  <PCAT_CMPD_ID> (1,124)
WAY-296993

>  <CNC_ID> (1,124)
359343437

>  <transfer_container_id> (1,124)
PTN000000068

>  <COMPOUND_NUMBER> (1,124)
WAY-296993

>  <BAR_CODE_NO> (1,124)
3897936

>  <LOCATION_CODE> (1,124)
PTNCS

>  <AMOUNT_CURRENT> (1,124)
33.3

$$$$
WAY-297020
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  2  0  0  0  0
 14 18  2  0  0  0  0
 15 19  2  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
  8 12  1  0  0  0  0
 10 11  2  0  0  0  0
 17 20  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,125)
1407

>  <Formula> (1,125)
C17H11BrN2O2

>  <MolWeight> (1,125)
355.18544

>  <PCAT_CMPD_ID> (1,125)
WAY-297020

>  <CNC_ID> (1,125)
359343464

>  <transfer_container_id> (1,125)
PTN000000068

>  <COMPOUND_NUMBER> (1,125)
WAY-297020

>  <BAR_CODE_NO> (1,125)
3897978

>  <LOCATION_CODE> (1,125)
PTNCS

>  <AMOUNT_CURRENT> (1,125)
33.1

$$$$
WAY-297023
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 11 16  2  0  0  0  0
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 25 27  1  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 20 22  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,126)
1408

>  <Formula> (1,126)
C23H20N2OS

>  <MolWeight> (1,126)
372.4827

>  <PCAT_CMPD_ID> (1,126)
WAY-297023

>  <CNC_ID> (1,126)
359343467

>  <transfer_container_id> (1,126)
PTN000000068

>  <COMPOUND_NUMBER> (1,126)
WAY-297023

>  <BAR_CODE_NO> (1,126)
3897983

>  <LOCATION_CODE> (1,126)
PTNCS

>  <AMOUNT_CURRENT> (1,126)
33.3

$$$$
WAY-297024
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 16 18  1  0  0  0  0
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 20 21  1  0  0  0  0
  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,127)
1409

>  <Formula> (1,127)
C15H10ClN3OS

>  <MolWeight> (1,127)
315.7774

>  <PCAT_CMPD_ID> (1,127)
WAY-297024

>  <CNC_ID> (1,127)
359343468

>  <transfer_container_id> (1,127)
PTN000000068

>  <COMPOUND_NUMBER> (1,127)
WAY-297024

>  <BAR_CODE_NO> (1,127)
3897984

>  <LOCATION_CODE> (1,127)
PTNCS

>  <AMOUNT_CURRENT> (1,127)
33

$$$$
WAY-297031
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,128)
1410

>  <Formula> (1,128)
C19H17NO4S

>  <MolWeight> (1,128)
355.40758

>  <PCAT_CMPD_ID> (1,128)
WAY-297031

>  <CNC_ID> (1,128)
359343475

>  <transfer_container_id> (1,128)
PTN000000068

>  <COMPOUND_NUMBER> (1,128)
WAY-297031

>  <BAR_CODE_NO> (1,128)
3897996

>  <LOCATION_CODE> (1,128)
PTNCS

>  <AMOUNT_CURRENT> (1,128)
33.2

$$$$
WAY-297037-A
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 13 17  1  0  0  0  0
  7  9  1  0  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,129)
1411

>  <Formula> (1,129)
C13H18N2O2

>  <MolWeight> (1,129)
234.29422

>  <PCAT_CMPD_ID> (1,129)
WAY-297037-A

>  <CNC_ID> (1,129)
359343481

>  <transfer_container_id> (1,129)
PTN000000068

>  <COMPOUND_NUMBER> (1,129)
WAY-297037-A

>  <BAR_CODE_NO> (1,129)
3898004

>  <LOCATION_CODE> (1,129)
PTNCS

>  <AMOUNT_CURRENT> (1,129)
33.3

$$$$
WAY-297045
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  5  7  2  0  0  0  0
  9 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,130)
1412

>  <Formula> (1,130)
C14H10BrN5O5

>  <MolWeight> (1,130)
408.1637

>  <PCAT_CMPD_ID> (1,130)
WAY-297045

>  <CNC_ID> (1,130)
359343489

>  <transfer_container_id> (1,130)
PTN000000068

>  <COMPOUND_NUMBER> (1,130)
WAY-297045

>  <BAR_CODE_NO> (1,130)
3898013

>  <LOCATION_CODE> (1,130)
PTNCS

>  <AMOUNT_CURRENT> (1,130)
33.4

$$$$
WAY-297046
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 14 18  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,131)
1413

>  <Formula> (1,131)
C19H14ClNO

>  <MolWeight> (1,131)
307.77356

>  <PCAT_CMPD_ID> (1,131)
WAY-297046

>  <CNC_ID> (1,131)
359343490

>  <transfer_container_id> (1,131)
PTN000000068

>  <COMPOUND_NUMBER> (1,131)
WAY-297046

>  <BAR_CODE_NO> (1,131)
3898014

>  <LOCATION_CODE> (1,131)
PTNCS

>  <AMOUNT_CURRENT> (1,131)
33.3

$$$$
WAY-297070
csChFnd80/10111816222D

 15 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,132)
1414

>  <Formula> (1,132)
C11H12N2OS

>  <MolWeight> (1,132)
220.29078

>  <PCAT_CMPD_ID> (1,132)
WAY-297070

>  <CNC_ID> (1,132)
359343514

>  <transfer_container_id> (1,132)
PTN000000068

>  <COMPOUND_NUMBER> (1,132)
WAY-297070

>  <BAR_CODE_NO> (1,132)
3898044

>  <LOCATION_CODE> (1,132)
PTNCS

>  <AMOUNT_CURRENT> (1,132)
33.4

$$$$
WAY-297091
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,133)
1415

>  <Formula> (1,133)
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>  <MolWeight> (1,133)
284.69386

>  <PCAT_CMPD_ID> (1,133)
WAY-297091

>  <CNC_ID> (1,133)
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>  <transfer_container_id> (1,133)
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>  <COMPOUND_NUMBER> (1,133)
WAY-297091

>  <BAR_CODE_NO> (1,133)
3898077

>  <LOCATION_CODE> (1,133)
PTNCS

>  <AMOUNT_CURRENT> (1,133)
33.2

$$$$
WAY-297107
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,134)
1416

>  <Formula> (1,134)
C16H17NO3

>  <MolWeight> (1,134)
271.31108

>  <PCAT_CMPD_ID> (1,134)
WAY-297107

>  <CNC_ID> (1,134)
359343551

>  <transfer_container_id> (1,134)
PTN000000068

>  <COMPOUND_NUMBER> (1,134)
WAY-297107

>  <BAR_CODE_NO> (1,134)
3898096

>  <LOCATION_CODE> (1,134)
PTNCS

>  <AMOUNT_CURRENT> (1,134)
33.3

$$$$
WAY-297157
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,135)
1417

>  <Formula> (1,135)
C16H18N2O2

>  <MolWeight> (1,135)
270.32632

>  <PCAT_CMPD_ID> (1,135)
WAY-297157

>  <CNC_ID> (1,135)
359343601

>  <transfer_container_id> (1,135)
PTN000000068

>  <COMPOUND_NUMBER> (1,135)
WAY-297157

>  <BAR_CODE_NO> (1,135)
3898156

>  <LOCATION_CODE> (1,135)
PTNCS

>  <AMOUNT_CURRENT> (1,135)
33.1

$$$$
WAY-297170-A
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,136)
1418

>  <Formula> (1,136)
C23H29N3O

>  <MolWeight> (1,136)
363.49586

>  <PCAT_CMPD_ID> (1,136)
WAY-297170-A

>  <CNC_ID> (1,136)
359343614

>  <transfer_container_id> (1,136)
PTN000000068

>  <COMPOUND_NUMBER> (1,136)
WAY-297170-A

>  <BAR_CODE_NO> (1,136)
3898176

>  <LOCATION_CODE> (1,136)
PTNCS

>  <AMOUNT_CURRENT> (1,136)
33.4

$$$$
WAY-297173
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,137)
1419

>  <Formula> (1,137)
C13H16N2O2S

>  <MolWeight> (1,137)
264.34334

>  <PCAT_CMPD_ID> (1,137)
WAY-297173

>  <CNC_ID> (1,137)
359343617

>  <transfer_container_id> (1,137)
PTN000000068

>  <COMPOUND_NUMBER> (1,137)
WAY-297173

>  <BAR_CODE_NO> (1,137)
3898181

>  <LOCATION_CODE> (1,137)
PTNCS

>  <AMOUNT_CURRENT> (1,137)
33.1

$$$$
WAY-297182
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,138)
1420

>  <Formula> (1,138)
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>  <MolWeight> (1,138)
473.8996696

>  <PCAT_CMPD_ID> (1,138)
WAY-297182

>  <CNC_ID> (1,138)
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>  <transfer_container_id> (1,138)
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>  <COMPOUND_NUMBER> (1,138)
WAY-297182

>  <BAR_CODE_NO> (1,138)
3898193

>  <LOCATION_CODE> (1,138)
PTNCS

>  <AMOUNT_CURRENT> (1,138)
33.2

$$$$
WAY-297191
csChFnd80/10111816222D

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  7  8  1  0  0  0  0
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,139)
1421

>  <Formula> (1,139)
C16H13FN2O

>  <MolWeight> (1,139)
268.2856232

>  <PCAT_CMPD_ID> (1,139)
WAY-297191

>  <CNC_ID> (1,139)
359343635

>  <transfer_container_id> (1,139)
PTN000000068

>  <COMPOUND_NUMBER> (1,139)
WAY-297191

>  <BAR_CODE_NO> (1,139)
3898210

>  <LOCATION_CODE> (1,139)
PTNCS

>  <AMOUNT_CURRENT> (1,139)
33.3

$$$$
WAY-297192
csChFnd80/10111816222D

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  8 12  1  0  0  0  0
 10 11  1  0  0  0  0
 16 18  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,140)
1422

>  <Formula> (1,140)
C18H11FN2O2S

>  <MolWeight> (1,140)
338.3555432

>  <PCAT_CMPD_ID> (1,140)
WAY-297192

>  <CNC_ID> (1,140)
359343636

>  <transfer_container_id> (1,140)
PTN000000068

>  <COMPOUND_NUMBER> (1,140)
WAY-297192

>  <BAR_CODE_NO> (1,140)
3898211

>  <LOCATION_CODE> (1,140)
PTNCS

>  <AMOUNT_CURRENT> (1,140)
33

$$$$
WAY-297196
csChFnd80/10111816222D

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 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,141)
1423

>  <Formula> (1,141)
C16H16N2OS

>  <MolWeight> (1,141)
284.37604

>  <PCAT_CMPD_ID> (1,141)
WAY-297196

>  <CNC_ID> (1,141)
359343640

>  <transfer_container_id> (1,141)
PTN000000068

>  <COMPOUND_NUMBER> (1,141)
WAY-297196

>  <BAR_CODE_NO> (1,141)
3898216

>  <LOCATION_CODE> (1,141)
PTNCS

>  <AMOUNT_CURRENT> (1,141)
33.2

$$$$
WAY-297234
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,142)
1424

>  <Formula> (1,142)
C15H12BrN3OS

>  <MolWeight> (1,142)
362.24428

>  <PCAT_CMPD_ID> (1,142)
WAY-297234

>  <CNC_ID> (1,142)
359343678

>  <transfer_container_id> (1,142)
PTN000000068

>  <COMPOUND_NUMBER> (1,142)
WAY-297234

>  <BAR_CODE_NO> (1,142)
3898282

>  <LOCATION_CODE> (1,142)
PTNCS

>  <AMOUNT_CURRENT> (1,142)
33.1

$$$$
WAY-297239
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,143)
1425

>  <Formula> (1,143)
C19H15Cl2F3N4O2

>  <MolWeight> (1,143)
459.2492096

>  <PCAT_CMPD_ID> (1,143)
WAY-297239

>  <CNC_ID> (1,143)
359343683

>  <transfer_container_id> (1,143)
PTN000000068

>  <COMPOUND_NUMBER> (1,143)
WAY-297239

>  <BAR_CODE_NO> (1,143)
3898290

>  <LOCATION_CODE> (1,143)
PTNCS

>  <AMOUNT_CURRENT> (1,143)
33.2

$$$$
WAY-297242
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,144)
1426

>  <Formula> (1,144)
C22H18ClN5O4S

>  <MolWeight> (1,144)
483.92742

>  <PCAT_CMPD_ID> (1,144)
WAY-297242

>  <CNC_ID> (1,144)
359343686

>  <transfer_container_id> (1,144)
PTN000000068

>  <COMPOUND_NUMBER> (1,144)
WAY-297242

>  <BAR_CODE_NO> (1,144)
3898296

>  <LOCATION_CODE> (1,144)
PTNCS

>  <AMOUNT_CURRENT> (1,144)
33.4

$$$$
WAY-297246
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,145)
1427

>  <Formula> (1,145)
C24H24N2O4

>  <MolWeight> (1,145)
404.45836

>  <PCAT_CMPD_ID> (1,145)
WAY-297246

>  <CNC_ID> (1,145)
359343690

>  <transfer_container_id> (1,145)
PTN000000068

>  <COMPOUND_NUMBER> (1,145)
WAY-297246

>  <BAR_CODE_NO> (1,145)
3898302

>  <LOCATION_CODE> (1,145)
PTNCS

>  <AMOUNT_CURRENT> (1,145)
33.2

$$$$
WAY-297247
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,146)
1428

>  <Formula> (1,146)
C19H18N2O7

>  <MolWeight> (1,146)
386.35542

>  <PCAT_CMPD_ID> (1,146)
WAY-297247

>  <CNC_ID> (1,146)
359343691

>  <transfer_container_id> (1,146)
PTN000000068

>  <COMPOUND_NUMBER> (1,146)
WAY-297247

>  <BAR_CODE_NO> (1,146)
3898303

>  <LOCATION_CODE> (1,146)
PTNCS

>  <AMOUNT_CURRENT> (1,146)
33.3

$$$$
WAY-297248
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,147)
1429

>  <Formula> (1,147)
C21H19N3O3

>  <MolWeight> (1,147)
361.39386

>  <PCAT_CMPD_ID> (1,147)
WAY-297248

>  <CNC_ID> (1,147)
359343692

>  <transfer_container_id> (1,147)
PTN000000068

>  <COMPOUND_NUMBER> (1,147)
WAY-297248

>  <BAR_CODE_NO> (1,147)
3898305

>  <LOCATION_CODE> (1,147)
PTNCS

>  <AMOUNT_CURRENT> (1,147)
33.1

$$$$
WAY-297254
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,148)
1430

>  <Formula> (1,148)
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>  <MolWeight> (1,148)
239.7245

>  <PCAT_CMPD_ID> (1,148)
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>  <CNC_ID> (1,148)
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>  <transfer_container_id> (1,148)
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>  <COMPOUND_NUMBER> (1,148)
WAY-297254

>  <BAR_CODE_NO> (1,148)
3898314

>  <LOCATION_CODE> (1,148)
PTNCS

>  <AMOUNT_CURRENT> (1,148)
33.2

$$$$
WAY-297267
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,149)
1431

>  <Formula> (1,149)
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>  <MolWeight> (1,149)
484.9421496

>  <PCAT_CMPD_ID> (1,149)
WAY-297267

>  <CNC_ID> (1,149)
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>  <transfer_container_id> (1,149)
PTN000000068

>  <COMPOUND_NUMBER> (1,149)
WAY-297267

>  <BAR_CODE_NO> (1,149)
3898334

>  <LOCATION_CODE> (1,149)
PTNCS

>  <AMOUNT_CURRENT> (1,149)
33.3

$$$$
WAY-297278
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,150)
1432

>  <Formula> (1,150)
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>  <PCAT_CMPD_ID> (1,150)
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>  <CNC_ID> (1,150)
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>  <transfer_container_id> (1,150)
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>  <COMPOUND_NUMBER> (1,150)
WAY-297278

>  <BAR_CODE_NO> (1,150)
3898353

>  <LOCATION_CODE> (1,150)
PTNCS

>  <AMOUNT_CURRENT> (1,150)
33.4

$$$$
WAY-297284
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,151)
1433

>  <Formula> (1,151)
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>  <MolWeight> (1,151)
359.44264

>  <PCAT_CMPD_ID> (1,151)
WAY-297284

>  <CNC_ID> (1,151)
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>  <transfer_container_id> (1,151)
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>  <COMPOUND_NUMBER> (1,151)
WAY-297284

>  <BAR_CODE_NO> (1,151)
3898360

>  <LOCATION_CODE> (1,151)
PTNCS

>  <AMOUNT_CURRENT> (1,151)
33.4

$$$$
WAY-297285
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,152)
1434

>  <Formula> (1,152)
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>  <MolWeight> (1,152)
373.46922

>  <PCAT_CMPD_ID> (1,152)
WAY-297285

>  <CNC_ID> (1,152)
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>  <transfer_container_id> (1,152)
PTN000000068

>  <COMPOUND_NUMBER> (1,152)
WAY-297285

>  <BAR_CODE_NO> (1,152)
3898361

>  <LOCATION_CODE> (1,152)
PTNCS

>  <AMOUNT_CURRENT> (1,152)
33.5

$$$$
WAY-297292
csChFnd80/10111816222D

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  7  8  1  0  0  0  0
 10 14  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,153)
1435

>  <Formula> (1,153)
C16H19NO3

>  <MolWeight> (1,153)
273.32696

>  <PCAT_CMPD_ID> (1,153)
WAY-297292

>  <CNC_ID> (1,153)
359343736

>  <transfer_container_id> (1,153)
PTN000000068

>  <COMPOUND_NUMBER> (1,153)
WAY-297292

>  <BAR_CODE_NO> (1,153)
3898372

>  <LOCATION_CODE> (1,153)
PTNCS

>  <AMOUNT_CURRENT> (1,153)
33.3

$$$$
WAY-297294
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,154)
1436

>  <Formula> (1,154)
C20H20N2O5

>  <MolWeight> (1,154)
368.3832

>  <PCAT_CMPD_ID> (1,154)
WAY-297294

>  <CNC_ID> (1,154)
359343738

>  <transfer_container_id> (1,154)
PTN000000068

>  <COMPOUND_NUMBER> (1,154)
WAY-297294

>  <BAR_CODE_NO> (1,154)
3898375

>  <LOCATION_CODE> (1,154)
PTNCS

>  <AMOUNT_CURRENT> (1,154)
33.4

$$$$
WAY-297306
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,155)
1437

>  <Formula> (1,155)
C22H16ClF4N5O2

>  <MolWeight> (1,155)
493.8413528

>  <PCAT_CMPD_ID> (1,155)
WAY-297306

>  <CNC_ID> (1,155)
359343750

>  <transfer_container_id> (1,155)
PTN000000068

>  <COMPOUND_NUMBER> (1,155)
WAY-297306

>  <BAR_CODE_NO> (1,155)
3898391

>  <LOCATION_CODE> (1,155)
PTNCS

>  <AMOUNT_CURRENT> (1,155)
33.3

$$$$
WAY-297314
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,156)
1438

>  <Formula> (1,156)
C13H9BrN4S

>  <MolWeight> (1,156)
333.20636

>  <PCAT_CMPD_ID> (1,156)
WAY-297314

>  <CNC_ID> (1,156)
359343758

>  <transfer_container_id> (1,156)
PTN000000068

>  <COMPOUND_NUMBER> (1,156)
WAY-297314

>  <BAR_CODE_NO> (1,156)
3898403

>  <LOCATION_CODE> (1,156)
PTNCS

>  <AMOUNT_CURRENT> (1,156)
33.3

$$$$
WAY-297315
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,157)
1439

>  <Formula> (1,157)
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>  <MolWeight> (1,157)
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>  <PCAT_CMPD_ID> (1,157)
WAY-297315

>  <CNC_ID> (1,157)
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>  <transfer_container_id> (1,157)
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>  <COMPOUND_NUMBER> (1,157)
WAY-297315

>  <BAR_CODE_NO> (1,157)
3898404

>  <LOCATION_CODE> (1,157)
PTNCS

>  <AMOUNT_CURRENT> (1,157)
33.1

$$$$
WAY-297334
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,158)
1440

>  <Formula> (1,158)
C17H17Cl2NO

>  <MolWeight> (1,158)
322.22898

>  <PCAT_CMPD_ID> (1,158)
WAY-297334

>  <CNC_ID> (1,158)
359343778

>  <transfer_container_id> (1,158)
PTN000000068

>  <COMPOUND_NUMBER> (1,158)
WAY-297334

>  <BAR_CODE_NO> (1,158)
3898431

>  <LOCATION_CODE> (1,158)
PTNCS

>  <AMOUNT_CURRENT> (1,158)
33.2

$$$$
WAY-297355
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,159)
1441

>  <Formula> (1,159)
C18H19N3O3S

>  <MolWeight> (1,159)
357.42676

>  <PCAT_CMPD_ID> (1,159)
WAY-297355

>  <CNC_ID> (1,159)
359343799

>  <transfer_container_id> (1,159)
PTN000000068

>  <COMPOUND_NUMBER> (1,159)
WAY-297355

>  <BAR_CODE_NO> (1,159)
3898462

>  <LOCATION_CODE> (1,159)
PTNCS

>  <AMOUNT_CURRENT> (1,159)
33.2

$$$$
WAY-297359
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,160)
1442

>  <Formula> (1,160)
C25H27F3N2O4

>  <MolWeight> (1,160)
476.4880896

>  <PCAT_CMPD_ID> (1,160)
WAY-297359

>  <CNC_ID> (1,160)
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>  <transfer_container_id> (1,160)
PTN000000068

>  <COMPOUND_NUMBER> (1,160)
WAY-297359

>  <BAR_CODE_NO> (1,160)
3898468

>  <LOCATION_CODE> (1,160)
PTNCS

>  <AMOUNT_CURRENT> (1,160)
33.5

$$$$
WAY-297360
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,161)
1443

>  <Formula> (1,161)
C13H14N2O3

>  <MolWeight> (1,161)
246.26186

>  <PCAT_CMPD_ID> (1,161)
WAY-297360

>  <CNC_ID> (1,161)
359343804

>  <transfer_container_id> (1,161)
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>  <COMPOUND_NUMBER> (1,161)
WAY-297360

>  <BAR_CODE_NO> (1,161)
3898469

>  <LOCATION_CODE> (1,161)
PTNCS

>  <AMOUNT_CURRENT> (1,161)
33.4

$$$$
WAY-297374
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,162)
1444

>  <Formula> (1,162)
C18H19N3O2

>  <MolWeight> (1,162)
309.36236

>  <PCAT_CMPD_ID> (1,162)
WAY-297374

>  <CNC_ID> (1,162)
359343818

>  <transfer_container_id> (1,162)
PTN000000068

>  <COMPOUND_NUMBER> (1,162)
WAY-297374

>  <BAR_CODE_NO> (1,162)
3898485

>  <LOCATION_CODE> (1,162)
PTNCS

>  <AMOUNT_CURRENT> (1,162)
33.4

$$$$
WAY-297405
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,163)
1445

>  <Formula> (1,163)
C23H17ClN4O2

>  <MolWeight> (1,163)
416.85968

>  <PCAT_CMPD_ID> (1,163)
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>  <CNC_ID> (1,163)
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>  <transfer_container_id> (1,163)
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>  <COMPOUND_NUMBER> (1,163)
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>  <BAR_CODE_NO> (1,163)
3898525

>  <LOCATION_CODE> (1,163)
PTNCS

>  <AMOUNT_CURRENT> (1,163)
26.8

$$$$
WAY-297423
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,164)
1446

>  <Formula> (1,164)
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>  <MolWeight> (1,164)
322.18592

>  <PCAT_CMPD_ID> (1,164)
WAY-297423

>  <CNC_ID> (1,164)
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>  <transfer_container_id> (1,164)
PTN000000068

>  <COMPOUND_NUMBER> (1,164)
WAY-297423

>  <BAR_CODE_NO> (1,164)
3898547

>  <LOCATION_CODE> (1,164)
PTNCS

>  <AMOUNT_CURRENT> (1,164)
33.1

$$$$
WAY-297429
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,165)
1447

>  <Formula> (1,165)
C20H17NO3S

>  <MolWeight> (1,165)
351.41888

>  <PCAT_CMPD_ID> (1,165)
WAY-297429

>  <CNC_ID> (1,165)
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>  <transfer_container_id> (1,165)
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>  <COMPOUND_NUMBER> (1,165)
WAY-297429

>  <BAR_CODE_NO> (1,165)
3898554

>  <LOCATION_CODE> (1,165)
PTNCS

>  <AMOUNT_CURRENT> (1,165)
33.1

$$$$
WAY-297438
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,166)
1448

>  <Formula> (1,166)
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>  <MolWeight> (1,166)
439.4744496

>  <PCAT_CMPD_ID> (1,166)
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>  <CNC_ID> (1,166)
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>  <transfer_container_id> (1,166)
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>  <COMPOUND_NUMBER> (1,166)
WAY-297438

>  <BAR_CODE_NO> (1,166)
3898565

>  <LOCATION_CODE> (1,166)
PTNCS

>  <AMOUNT_CURRENT> (1,166)
33.4

$$$$
WAY-297454
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,167)
1449

>  <Formula> (1,167)
C17H16N2O2S

>  <MolWeight> (1,167)
312.38614

>  <PCAT_CMPD_ID> (1,167)
WAY-297454

>  <CNC_ID> (1,167)
359343898

>  <transfer_container_id> (1,167)
PTN000000068

>  <COMPOUND_NUMBER> (1,167)
WAY-297454

>  <BAR_CODE_NO> (1,167)
3898586

>  <LOCATION_CODE> (1,167)
PTNCS

>  <AMOUNT_CURRENT> (1,167)
33.4

$$$$
WAY-297462
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,168)
1450

>  <Formula> (1,168)
C13H13ClN2O2S2

>  <MolWeight> (1,168)
328.83752

>  <PCAT_CMPD_ID> (1,168)
WAY-297462

>  <CNC_ID> (1,168)
359343906

>  <transfer_container_id> (1,168)
PTN000000068

>  <COMPOUND_NUMBER> (1,168)
WAY-297462

>  <BAR_CODE_NO> (1,168)
3898594

>  <LOCATION_CODE> (1,168)
PTNCS

>  <AMOUNT_CURRENT> (1,168)
33.1

$$$$
WAY-297464
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,169)
1451

>  <Formula> (1,169)
C26H29N3O2

>  <MolWeight> (1,169)
415.52736

>  <PCAT_CMPD_ID> (1,169)
WAY-297464

>  <CNC_ID> (1,169)
359343908

>  <transfer_container_id> (1,169)
PTN000000068

>  <COMPOUND_NUMBER> (1,169)
WAY-297464

>  <BAR_CODE_NO> (1,169)
3898597

>  <LOCATION_CODE> (1,169)
PTNCS

>  <AMOUNT_CURRENT> (1,169)
33.5

$$$$
WAY-297807
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,170)
1452

>  <Formula> (1,170)
C18H20N4O4S

>  <MolWeight> (1,170)
388.4408

>  <PCAT_CMPD_ID> (1,170)
WAY-297807

>  <CNC_ID> (1,170)
359344251

>  <transfer_container_id> (1,170)
PTN000000068

>  <COMPOUND_NUMBER> (1,170)
WAY-297807

>  <BAR_CODE_NO> (1,170)
3899056

>  <LOCATION_CODE> (1,170)
PTNCS

>  <AMOUNT_CURRENT> (1,170)
33.1

$$$$
WAY-297808
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 21 23  1  0  0  0  0
  5  7  1  0  0  0  0
  9 13  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,171)
1453

>  <Formula> (1,171)
C16H14N2O4S

>  <MolWeight> (1,171)
330.35836

>  <PCAT_CMPD_ID> (1,171)
WAY-297808

>  <CNC_ID> (1,171)
359344252

>  <transfer_container_id> (1,171)
PTN000000068

>  <COMPOUND_NUMBER> (1,171)
WAY-297808

>  <BAR_CODE_NO> (1,171)
3899058

>  <LOCATION_CODE> (1,171)
PTNCS

>  <AMOUNT_CURRENT> (1,171)
33.1

$$$$
WAY-297520-A
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,172)
1454

>  <Formula> (1,172)
C19H19N3O3S

>  <MolWeight> (1,172)
369.43746

>  <PCAT_CMPD_ID> (1,172)
WAY-297520-A

>  <CNC_ID> (1,172)
359343964

>  <transfer_container_id> (1,172)
PTN000000068

>  <COMPOUND_NUMBER> (1,172)
WAY-297520-A

>  <BAR_CODE_NO> (1,172)
3898674

>  <LOCATION_CODE> (1,172)
PTNCS

>  <AMOUNT_CURRENT> (1,172)
33.1

$$$$
WAY-297561
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
   -1.6756    0.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  5 10  2  0  0  0  0
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 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  7 11  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (1,173)
1455

>  <Formula> (1,173)
C15H21N3O2

>  <MolWeight> (1,173)
275.34614

>  <PCAT_CMPD_ID> (1,173)
WAY-297561

>  <CNC_ID> (1,173)
359344005

>  <transfer_container_id> (1,173)
PTN000000068

>  <COMPOUND_NUMBER> (1,173)
WAY-297561

>  <BAR_CODE_NO> (1,173)
3898727

>  <LOCATION_CODE> (1,173)
PTNCS

>  <AMOUNT_CURRENT> (1,173)
33

$$$$
WAY-297563
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -0.1599    0.3174    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4 10  1  0  0  0  0
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  8 13  1  0  0  0  0
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 10 15  1  0  0  0  0
 10 16  2  0  0  0  0
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 15 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  1  0  0  0  0
  6  9  1  0  0  0  0
 13 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,174)
1456

>  <Formula> (1,174)
C17H21N3O2

>  <MolWeight> (1,174)
299.36754

>  <PCAT_CMPD_ID> (1,174)
WAY-297563

>  <CNC_ID> (1,174)
359344007

>  <transfer_container_id> (1,174)
PTN000000068

>  <COMPOUND_NUMBER> (1,174)
WAY-297563

>  <BAR_CODE_NO> (1,174)
3898730

>  <LOCATION_CODE> (1,174)
PTNCS

>  <AMOUNT_CURRENT> (1,174)
33.2

$$$$
WAY-297580
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.3897   -0.4862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 10 13  1  0  0  0  0
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 19 22  1  0  0  0  0
  7  8  1  0  0  0  0
 11 13  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,175)
1457

>  <Formula> (1,175)
C17H21ClN2O2

>  <MolWeight> (1,175)
320.81384

>  <PCAT_CMPD_ID> (1,175)
WAY-297580

>  <CNC_ID> (1,175)
359344024

>  <transfer_container_id> (1,175)
PTN000000068

>  <COMPOUND_NUMBER> (1,175)
WAY-297580

>  <BAR_CODE_NO> (1,175)
3898749

>  <LOCATION_CODE> (1,175)
PTNCS

>  <AMOUNT_CURRENT> (1,175)
33

$$$$
WAY-297596
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
  5  7  1  0  0  0  0
  8 10  2  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,176)
1458

>  <Formula> (1,176)
C15H13Cl2N3

>  <MolWeight> (1,176)
306.18982

>  <PCAT_CMPD_ID> (1,176)
WAY-297596

>  <CNC_ID> (1,176)
359344040

>  <transfer_container_id> (1,176)
PTN000000068

>  <COMPOUND_NUMBER> (1,176)
WAY-297596

>  <BAR_CODE_NO> (1,176)
3898772

>  <LOCATION_CODE> (1,176)
PTNCS

>  <AMOUNT_CURRENT> (1,176)
33.2

$$$$
WAY-297603
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,177)
1459

>  <Formula> (1,177)
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>  <MolWeight> (1,177)
341.18926

>  <PCAT_CMPD_ID> (1,177)
WAY-297603

>  <CNC_ID> (1,177)
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>  <transfer_container_id> (1,177)
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>  <COMPOUND_NUMBER> (1,177)
WAY-297603

>  <BAR_CODE_NO> (1,177)
3898780

>  <LOCATION_CODE> (1,177)
PTNCS

>  <AMOUNT_CURRENT> (1,177)
33

$$$$
WAY-297608
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,178)
1460

>  <Formula> (1,178)
C16H17ClN2O4S

>  <MolWeight> (1,178)
368.83518

>  <PCAT_CMPD_ID> (1,178)
WAY-297608

>  <CNC_ID> (1,178)
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>  <transfer_container_id> (1,178)
PTN000000068

>  <COMPOUND_NUMBER> (1,178)
WAY-297608

>  <BAR_CODE_NO> (1,178)
3898785

>  <LOCATION_CODE> (1,178)
PTNCS

>  <AMOUNT_CURRENT> (1,178)
33.2

$$$$
WAY-297609
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,179)
1461

>  <Formula> (1,179)
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>  <MolWeight> (1,179)
231.29358

>  <PCAT_CMPD_ID> (1,179)
WAY-297609

>  <CNC_ID> (1,179)
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>  <transfer_container_id> (1,179)
PTN000000068

>  <COMPOUND_NUMBER> (1,179)
WAY-297609

>  <BAR_CODE_NO> (1,179)
3898786

>  <LOCATION_CODE> (1,179)
PTNCS

>  <AMOUNT_CURRENT> (1,179)
33.1

$$$$
WAY-297617
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,180)
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>  <Formula> (1,180)
C11H11BrN4O4

>  <MolWeight> (1,180)
343.13344

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>  <CNC_ID> (1,180)
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>  <transfer_container_id> (1,180)
PTN000000068

>  <COMPOUND_NUMBER> (1,180)
WAY-297617

>  <BAR_CODE_NO> (1,180)
3898798

>  <LOCATION_CODE> (1,180)
PTNCS

>  <AMOUNT_CURRENT> (1,180)
33.3

$$$$
WAY-297621
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1,181)
1463

>  <Formula> (1,181)
C19H24N2O3S

>  <MolWeight> (1,181)
360.47046

>  <PCAT_CMPD_ID> (1,181)
WAY-297621

>  <CNC_ID> (1,181)
359344065

>  <transfer_container_id> (1,181)
PTN000000068

>  <COMPOUND_NUMBER> (1,181)
WAY-297621

>  <BAR_CODE_NO> (1,181)
3898802

>  <LOCATION_CODE> (1,181)
PTNCS

>  <AMOUNT_CURRENT> (1,181)
33.1

$$$$
WAY-297626
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,182)
1464

>  <Formula> (1,182)
C9H14N4O4S

>  <MolWeight> (1,182)
274.29686

>  <PCAT_CMPD_ID> (1,182)
WAY-297626

>  <CNC_ID> (1,182)
359344070

>  <transfer_container_id> (1,182)
PTN000000068

>  <COMPOUND_NUMBER> (1,182)
WAY-297626

>  <BAR_CODE_NO> (1,182)
3898809

>  <LOCATION_CODE> (1,182)
PTNCS

>  <AMOUNT_CURRENT> (1,182)
33.1

$$$$
WAY-297643
csChFnd80/10111816222D

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 23 19  1  0  0  0  0
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 22 23  2  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,183)
1465

>  <Formula> (1,183)
C17H17NO5

>  <MolWeight> (1,183)
315.32058

>  <PCAT_CMPD_ID> (1,183)
WAY-297643

>  <CNC_ID> (1,183)
359344087

>  <transfer_container_id> (1,183)
PTN000000068

>  <COMPOUND_NUMBER> (1,183)
WAY-297643

>  <BAR_CODE_NO> (1,183)
3898834

>  <LOCATION_CODE> (1,183)
PTNCS

>  <AMOUNT_CURRENT> (1,183)
33.2

$$$$
WAY-297656
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,184)
1466

>  <Formula> (1,184)
C20H17NO5S2

>  <MolWeight> (1,184)
415.48268

>  <PCAT_CMPD_ID> (1,184)
WAY-297656

>  <CNC_ID> (1,184)
359344100

>  <transfer_container_id> (1,184)
PTN000000068

>  <COMPOUND_NUMBER> (1,184)
WAY-297656

>  <BAR_CODE_NO> (1,184)
3898851

>  <LOCATION_CODE> (1,184)
PTNCS

>  <AMOUNT_CURRENT> (1,184)
33.4

$$$$
WAY-297661
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
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 16  7  2  0  0  0  0
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 14 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,185)
1467

>  <Formula> (1,185)
C15H16N2O3S2

>  <MolWeight> (1,185)
336.42914

>  <PCAT_CMPD_ID> (1,185)
WAY-297661

>  <CNC_ID> (1,185)
359344105

>  <transfer_container_id> (1,185)
PTN000000068

>  <COMPOUND_NUMBER> (1,185)
WAY-297661

>  <BAR_CODE_NO> (1,185)
3898858

>  <LOCATION_CODE> (1,185)
PTNCS

>  <AMOUNT_CURRENT> (1,185)
33.1

$$$$
WAY-297667
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,186)
1468

>  <Formula> (1,186)
C19H13N3OS2

>  <MolWeight> (1,186)
363.45602

>  <PCAT_CMPD_ID> (1,186)
WAY-297667

>  <CNC_ID> (1,186)
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>  <transfer_container_id> (1,186)
PTN000000068

>  <COMPOUND_NUMBER> (1,186)
WAY-297667

>  <BAR_CODE_NO> (1,186)
3898866

>  <LOCATION_CODE> (1,186)
PTNCS

>  <AMOUNT_CURRENT> (1,186)
33

$$$$
WAY-297696-A
csChFnd80/10111816222D

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  1  2  1  0  0  0  0
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  1  4  2  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
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 18 19  1  0  0  0  0
  7  8  1  0  0  0  0
 10 12  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,187)
1469

>  <Formula> (1,187)
C14H11N3OS

>  <MolWeight> (1,187)
269.32164

>  <PCAT_CMPD_ID> (1,187)
WAY-297696-A

>  <CNC_ID> (1,187)
359344140

>  <transfer_container_id> (1,187)
PTN000000068

>  <COMPOUND_NUMBER> (1,187)
WAY-297696-A

>  <BAR_CODE_NO> (1,187)
3898905

>  <LOCATION_CODE> (1,187)
PTNCS

>  <AMOUNT_CURRENT> (1,187)
33.2

$$$$
WAY-297698
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  8  5  1  0  0  0  0
  9  3  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  2  0  0  0  0
 12 11  1  0  0  0  0
 13  8  2  0  0  0  0
 14  5  2  0  0  0  0
 15 13  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 18 11  1  0  0  0  0
 19 12  1  0  0  0  0
 20 17  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
  6  8  1  0  0  0  0
  7  4  1  0  0  0  0
 10 12  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,188)
1470

>  <Formula> (1,188)
C20H16N2OS

>  <MolWeight> (1,188)
332.41884

>  <PCAT_CMPD_ID> (1,188)
WAY-297698

>  <CNC_ID> (1,188)
359344142

>  <transfer_container_id> (1,188)
PRL000000078

>  <COMPOUND_NUMBER> (1,188)
WAY-297698

>  <BAR_CODE_NO> (1,188)
3928907

>  <LOCATION_CODE> (1,188)
PRLCS

>  <AMOUNT_CURRENT> (1,188)
33.1

$$$$
WAY-297700
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 15 18  2  0  0  0  0
 16 19  2  0  0  0  0
 16 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 10  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,189)
1471

>  <Formula> (1,189)
C18H17NO4S

>  <MolWeight> (1,189)
343.39688

>  <PCAT_CMPD_ID> (1,189)
WAY-297700

>  <CNC_ID> (1,189)
359344144

>  <transfer_container_id> (1,189)
PTN000000068

>  <COMPOUND_NUMBER> (1,189)
WAY-297700

>  <BAR_CODE_NO> (1,189)
3898910

>  <LOCATION_CODE> (1,189)
PTNCS

>  <AMOUNT_CURRENT> (1,189)
33.4

$$$$
WAY-297705
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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 11 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,190)
1472

>  <Formula> (1,190)
C15H16ClN5O4

>  <MolWeight> (1,190)
365.77164

>  <PCAT_CMPD_ID> (1,190)
WAY-297705

>  <CNC_ID> (1,190)
359344149

>  <transfer_container_id> (1,190)
PTN000000068

>  <COMPOUND_NUMBER> (1,190)
WAY-297705

>  <BAR_CODE_NO> (1,190)
3898917

>  <LOCATION_CODE> (1,190)
PTNCS

>  <AMOUNT_CURRENT> (1,190)
33.5

$$$$
WAY-297707
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  2  5  2  0  0  0  0
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 11 14  2  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 22 24  1  0  0  0  0
  7  8  2  0  0  0  0
 10 13  1  0  0  0  0
 14 15  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,191)
1473

>  <Formula> (1,191)
C18H11ClN2O2S

>  <MolWeight> (1,191)
354.81014

>  <PCAT_CMPD_ID> (1,191)
WAY-297707

>  <CNC_ID> (1,191)
359344151

>  <transfer_container_id> (1,191)
PRL000000078

>  <COMPOUND_NUMBER> (1,191)
WAY-297707

>  <BAR_CODE_NO> (1,191)
3928919

>  <LOCATION_CODE> (1,191)
PRLCS

>  <AMOUNT_CURRENT> (1,191)
33

$$$$
WAY-297716
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,192)
1474

>  <Formula> (1,192)
C16H15FN2O5S

>  <MolWeight> (1,192)
366.3641032

>  <PCAT_CMPD_ID> (1,192)
WAY-297716

>  <CNC_ID> (1,192)
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>  <transfer_container_id> (1,192)
PTN000000068

>  <COMPOUND_NUMBER> (1,192)
WAY-297716

>  <BAR_CODE_NO> (1,192)
3898929

>  <LOCATION_CODE> (1,192)
PTNCS

>  <AMOUNT_CURRENT> (1,192)
33.4

$$$$
WAY-297724
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,193)
1475

>  <Formula> (1,193)
C15H17NO4S

>  <MolWeight> (1,193)
307.36478

>  <PCAT_CMPD_ID> (1,193)
WAY-297724

>  <CNC_ID> (1,193)
359344168

>  <transfer_container_id> (1,193)
PTN000000068

>  <COMPOUND_NUMBER> (1,193)
WAY-297724

>  <BAR_CODE_NO> (1,193)
3898939

>  <LOCATION_CODE> (1,193)
PTNCS

>  <AMOUNT_CURRENT> (1,193)
33.5

$$$$
WAY-297733
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,194)
1476

>  <Formula> (1,194)
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>  <MolWeight> (1,194)
227.7105

>  <PCAT_CMPD_ID> (1,194)
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>  <CNC_ID> (1,194)
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>  <transfer_container_id> (1,194)
PTN000000068

>  <COMPOUND_NUMBER> (1,194)
WAY-297733

>  <BAR_CODE_NO> (1,194)
3898954

>  <LOCATION_CODE> (1,194)
PTNCS

>  <AMOUNT_CURRENT> (1,194)
33.5

$$$$
WAY-297748
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,195)
1477

>  <Formula> (1,195)
C11H10N2O3S2

>  <MolWeight> (1,195)
282.3387

>  <PCAT_CMPD_ID> (1,195)
WAY-297748

>  <CNC_ID> (1,195)
359344192

>  <transfer_container_id> (1,195)
PTN000000068

>  <COMPOUND_NUMBER> (1,195)
WAY-297748

>  <BAR_CODE_NO> (1,195)
3898973

>  <LOCATION_CODE> (1,195)
PTNCS

>  <AMOUNT_CURRENT> (1,195)
33.4

$$$$
WAY-297749
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,196)
1478

>  <Formula> (1,196)
C21H18N2O2

>  <MolWeight> (1,196)
330.37982

>  <PCAT_CMPD_ID> (1,196)
WAY-297749

>  <CNC_ID> (1,196)
359344193

>  <transfer_container_id> (1,196)
PTN000000068

>  <COMPOUND_NUMBER> (1,196)
WAY-297749

>  <BAR_CODE_NO> (1,196)
3898977

>  <LOCATION_CODE> (1,196)
PTNCS

>  <AMOUNT_CURRENT> (1,196)
33.4

$$$$
WAY-297750
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,197)
1479

>  <Formula> (1,197)
C19H18N2OS

>  <MolWeight> (1,197)
322.42402

>  <PCAT_CMPD_ID> (1,197)
WAY-297750

>  <CNC_ID> (1,197)
359344194

>  <transfer_container_id> (1,197)
PTN000000068

>  <COMPOUND_NUMBER> (1,197)
WAY-297750

>  <BAR_CODE_NO> (1,197)
3898979

>  <LOCATION_CODE> (1,197)
PTNCS

>  <AMOUNT_CURRENT> (1,197)
33.4

$$$$
WAY-297759
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,198)
1480

>  <Formula> (1,198)
C11H11BrN2O3

>  <MolWeight> (1,198)
299.12064

>  <PCAT_CMPD_ID> (1,198)
WAY-297759

>  <CNC_ID> (1,198)
359344203

>  <transfer_container_id> (1,198)
PTN000000068

>  <COMPOUND_NUMBER> (1,198)
WAY-297759

>  <BAR_CODE_NO> (1,198)
3898991

>  <LOCATION_CODE> (1,198)
PTNCS

>  <AMOUNT_CURRENT> (1,198)
33.3

$$$$
WAY-297779
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  2  1  0  0  0  0
 12  4  2  0  0  0  0
 13  9  1  0  0  0  0
 14  5  1  0  0  0  0
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 16  8  1  0  0  0  0
 17  8  1  0  0  0  0
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  3  7  1  0  0  0  0
 18 11  2  0  0  0  0
 15 20  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,199)
1481

>  <Formula> (1,199)
C19H18N2O2

>  <MolWeight> (1,199)
306.35842

>  <PCAT_CMPD_ID> (1,199)
WAY-297779

>  <CNC_ID> (1,199)
359344223

>  <transfer_container_id> (1,199)
PTN000000068

>  <COMPOUND_NUMBER> (1,199)
WAY-297779

>  <BAR_CODE_NO> (1,199)
3899021

>  <LOCATION_CODE> (1,199)
PTNCS

>  <AMOUNT_CURRENT> (1,199)
33.2

$$$$
WAY-297836
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,200)
1482

>  <Formula> (1,200)
C14H14N4O2S

>  <MolWeight> (1,200)
302.35156

>  <PCAT_CMPD_ID> (1,200)
WAY-297836

>  <CNC_ID> (1,200)
359344280

>  <transfer_container_id> (1,200)
PTN000000068

>  <COMPOUND_NUMBER> (1,200)
WAY-297836

>  <BAR_CODE_NO> (1,200)
3899096

>  <LOCATION_CODE> (1,200)
PTNCS

>  <AMOUNT_CURRENT> (1,200)
33.1

$$$$
WAY-297839
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 21 22  2  0  0  0  0
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M  END
>  <Mol_ID> (1,201)
1483

>  <Formula> (1,201)
C22H19F3N4O3S

>  <MolWeight> (1,201)
476.4714696

>  <PCAT_CMPD_ID> (1,201)
WAY-297839

>  <CNC_ID> (1,201)
359344283

>  <transfer_container_id> (1,201)
PTN000000068

>  <COMPOUND_NUMBER> (1,201)
WAY-297839

>  <BAR_CODE_NO> (1,201)
3899100

>  <LOCATION_CODE> (1,201)
PTNCS

>  <AMOUNT_CURRENT> (1,201)
33.3

$$$$
WAY-297845
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,202)
1484

>  <Formula> (1,202)
C17H20N2O4S

>  <MolWeight> (1,202)
348.4167

>  <PCAT_CMPD_ID> (1,202)
WAY-297845

>  <CNC_ID> (1,202)
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>  <transfer_container_id> (1,202)
PTN000000068

>  <COMPOUND_NUMBER> (1,202)
WAY-297845

>  <BAR_CODE_NO> (1,202)
3899107

>  <LOCATION_CODE> (1,202)
PTNCS

>  <AMOUNT_CURRENT> (1,202)
33.4

$$$$
WAY-297847
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,203)
1485

>  <Formula> (1,203)
C16H16N2O4

>  <MolWeight> (1,203)
300.30924

>  <PCAT_CMPD_ID> (1,203)
WAY-297847

>  <CNC_ID> (1,203)
359344291

>  <transfer_container_id> (1,203)
PTN000000068

>  <COMPOUND_NUMBER> (1,203)
WAY-297847

>  <BAR_CODE_NO> (1,203)
3899111

>  <LOCATION_CODE> (1,203)
PTNCS

>  <AMOUNT_CURRENT> (1,203)
33.1

$$$$
WAY-297848
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,204)
1486

>  <Formula> (1,204)
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>  <MolWeight> (1,204)
296.77252

>  <PCAT_CMPD_ID> (1,204)
WAY-297848

>  <CNC_ID> (1,204)
359344292

>  <transfer_container_id> (1,204)
PTN000000068

>  <COMPOUND_NUMBER> (1,204)
WAY-297848

>  <BAR_CODE_NO> (1,204)
3899113

>  <LOCATION_CODE> (1,204)
PTNCS

>  <AMOUNT_CURRENT> (1,204)
33.3

$$$$
WAY-297855
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,205)
1487

>  <Formula> (1,205)
C13H13BrN2O3S

>  <MolWeight> (1,205)
357.22292

>  <PCAT_CMPD_ID> (1,205)
WAY-297855

>  <CNC_ID> (1,205)
359344299

>  <transfer_container_id> (1,205)
PTN000000068

>  <COMPOUND_NUMBER> (1,205)
WAY-297855

>  <BAR_CODE_NO> (1,205)
3899123

>  <LOCATION_CODE> (1,205)
PTNCS

>  <AMOUNT_CURRENT> (1,205)
33.4

$$$$
WAY-297857
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,206)
1488

>  <Formula> (1,206)
C17H16N2O2S

>  <MolWeight> (1,206)
312.38614

>  <PCAT_CMPD_ID> (1,206)
WAY-297857

>  <CNC_ID> (1,206)
359344301

>  <transfer_container_id> (1,206)
PTN000000068

>  <COMPOUND_NUMBER> (1,206)
WAY-297857

>  <BAR_CODE_NO> (1,206)
3899125

>  <LOCATION_CODE> (1,206)
PTNCS

>  <AMOUNT_CURRENT> (1,206)
33

$$$$
WAY-297861
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,207)
1489

>  <Formula> (1,207)
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>  <MolWeight> (1,207)
366.47504

>  <PCAT_CMPD_ID> (1,207)
WAY-297861

>  <CNC_ID> (1,207)
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>  <transfer_container_id> (1,207)
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>  <COMPOUND_NUMBER> (1,207)
WAY-297861

>  <BAR_CODE_NO> (1,207)
3899129

>  <LOCATION_CODE> (1,207)
PTNCS

>  <AMOUNT_CURRENT> (1,207)
33.3

$$$$
WAY-297884
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 16 20  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,208)
1490

>  <Formula> (1,208)
C20H14F3NO

>  <MolWeight> (1,208)
341.3264696

>  <PCAT_CMPD_ID> (1,208)
WAY-297884

>  <CNC_ID> (1,208)
359344328

>  <transfer_container_id> (1,208)
PTN000000068

>  <COMPOUND_NUMBER> (1,208)
WAY-297884

>  <BAR_CODE_NO> (1,208)
3899160

>  <LOCATION_CODE> (1,208)
PTNCS

>  <AMOUNT_CURRENT> (1,208)
33.1

$$$$
WAY-297910
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,209)
1491

>  <Formula> (1,209)
C18H9Cl2F3N4O2

>  <MolWeight> (1,209)
441.1908696

>  <PCAT_CMPD_ID> (1,209)
WAY-297910

>  <CNC_ID> (1,209)
359344354

>  <transfer_container_id> (1,209)
PTN000000068

>  <COMPOUND_NUMBER> (1,209)
WAY-297910

>  <BAR_CODE_NO> (1,209)
3899189

>  <LOCATION_CODE> (1,209)
PTNCS

>  <AMOUNT_CURRENT> (1,209)
33.4

$$$$
WAY-297926
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
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M  END
>  <Mol_ID> (1,210)
1492

>  <Formula> (1,210)
C25H25N3O2S

>  <MolWeight> (1,210)
431.5499

>  <PCAT_CMPD_ID> (1,210)
WAY-297926

>  <CNC_ID> (1,210)
359344370

>  <transfer_container_id> (1,210)
PTN000000068

>  <COMPOUND_NUMBER> (1,210)
WAY-297926

>  <BAR_CODE_NO> (1,210)
3899207

>  <LOCATION_CODE> (1,210)
PTNCS

>  <AMOUNT_CURRENT> (1,210)
33.2

$$$$
WAY-297961
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 20 22  1  0  0  0  0
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 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,211)
1493

>  <Formula> (1,211)
C16H14Cl2N2O3

>  <MolWeight> (1,211)
353.19996

>  <PCAT_CMPD_ID> (1,211)
WAY-297961

>  <CNC_ID> (1,211)
359344405

>  <transfer_container_id> (1,211)
PTN000000068

>  <COMPOUND_NUMBER> (1,211)
WAY-297961

>  <BAR_CODE_NO> (1,211)
3899259

>  <LOCATION_CODE> (1,211)
PTNCS

>  <AMOUNT_CURRENT> (1,211)
33.2

$$$$
WAY-297963-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,212)
1494

>  <Formula> (1,212)
C18H16N4OS

>  <MolWeight> (1,212)
336.41084

>  <PCAT_CMPD_ID> (1,212)
WAY-297963-A

>  <CNC_ID> (1,212)
359344407

>  <transfer_container_id> (1,212)
PTN000000068

>  <COMPOUND_NUMBER> (1,212)
WAY-297963-A

>  <BAR_CODE_NO> (1,212)
3899262

>  <LOCATION_CODE> (1,212)
PTNCS

>  <AMOUNT_CURRENT> (1,212)
33.1

$$$$
WAY-297969
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,213)
1495

>  <Formula> (1,213)
C11H8N2O4S2

>  <MolWeight> (1,213)
296.32222

>  <PCAT_CMPD_ID> (1,213)
WAY-297969

>  <CNC_ID> (1,213)
359344413

>  <transfer_container_id> (1,213)
PTN000000068

>  <COMPOUND_NUMBER> (1,213)
WAY-297969

>  <BAR_CODE_NO> (1,213)
3899271

>  <LOCATION_CODE> (1,213)
PTNCS

>  <AMOUNT_CURRENT> (1,213)
33

$$$$
WAY-297993
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,214)
1496

>  <Formula> (1,214)
C21H13N3O5

>  <MolWeight> (1,214)
387.34502

>  <PCAT_CMPD_ID> (1,214)
WAY-297993

>  <CNC_ID> (1,214)
359344437

>  <transfer_container_id> (1,214)
PTN000000068

>  <COMPOUND_NUMBER> (1,214)
WAY-297993

>  <BAR_CODE_NO> (1,214)
3899299

>  <LOCATION_CODE> (1,214)
PTNCS

>  <AMOUNT_CURRENT> (1,214)
33.5

$$$$
WAY-335404
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
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 30 27  1  0  0  0  0
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M  END
>  <Mol_ID> (1,215)
1497

>  <Formula> (1,215)
C24H20N4O2S

>  <MolWeight> (1,215)
428.5062

>  <PCAT_CMPD_ID> (1,215)
WAY-335404

>  <CNC_ID> (1,215)
359344665

>  <transfer_container_id> (1,215)
PTN000000071

>  <COMPOUND_NUMBER> (1,215)
WAY-335404

>  <BAR_CODE_NO> (1,215)
2543608

>  <LOCATION_CODE> (1,215)
PTNCS

>  <AMOUNT_CURRENT> (1,215)
32.1

$$$$
WAY-335445
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,216)
1498

>  <Formula> (1,216)
C21H16N2O2

>  <MolWeight> (1,216)
328.36394

>  <PCAT_CMPD_ID> (1,216)
WAY-335445

>  <CNC_ID> (1,216)
359344706

>  <transfer_container_id> (1,216)
PTN000000076

>  <COMPOUND_NUMBER> (1,216)
WAY-335445

>  <BAR_CODE_NO> (1,216)
2569054

>  <LOCATION_CODE> (1,216)
PTNCS

>  <AMOUNT_CURRENT> (1,216)
32.3

$$$$
WL-133541
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,217)
1499

>  <Formula> (1,217)
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>  <MolWeight> (1,217)
318.7549

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WL-133541

>  <CNC_ID> (1,217)
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>  <transfer_container_id> (1,217)
PTN000000068

>  <COMPOUND_NUMBER> (1,217)
WL-133541

>  <BAR_CODE_NO> (1,217)
3897423

>  <LOCATION_CODE> (1,217)
PTNCS

>  <AMOUNT_CURRENT> (1,217)
33.1

$$$$
WL-148210
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,218)
1500

>  <Formula> (1,218)
C15H9NO3

>  <MolWeight> (1,218)
251.23686

>  <PCAT_CMPD_ID> (1,218)
WL-148210

>  <CNC_ID> (1,218)
359353671

>  <transfer_container_id> (1,218)
PTN000000068

>  <COMPOUND_NUMBER> (1,218)
WL-148210

>  <BAR_CODE_NO> (1,218)
3897959

>  <LOCATION_CODE> (1,218)
PTNCS

>  <AMOUNT_CURRENT> (1,218)
33.5

$$$$
WL-155514
csChFnd80/10111816222D

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 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,219)
1501

>  <Formula> (1,219)
C16H17N5O

>  <MolWeight> (1,219)
295.33908

>  <PCAT_CMPD_ID> (1,219)
WL-155514

>  <CNC_ID> (1,219)
359353674

>  <transfer_container_id> (1,219)
PTN000000068

>  <COMPOUND_NUMBER> (1,219)
WL-155514

>  <BAR_CODE_NO> (1,219)
3899079

>  <LOCATION_CODE> (1,219)
PTNCS

>  <AMOUNT_CURRENT> (1,219)
33.4

$$$$
WL-166459
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,220)
1502

>  <Formula> (1,220)
C24H21N3O

>  <MolWeight> (1,220)
367.44304

>  <PCAT_CMPD_ID> (1,220)
WL-166459

>  <CNC_ID> (1,220)
359353676

>  <transfer_container_id> (1,220)
PTN000000068

>  <COMPOUND_NUMBER> (1,220)
WL-166459

>  <BAR_CODE_NO> (1,220)
3898495

>  <LOCATION_CODE> (1,220)
PTNCS

>  <AMOUNT_CURRENT> (1,220)
33.5

$$$$
WL-179356
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,221)
1503

>  <Formula> (1,221)
C12H7ClN2OS2

>  <MolWeight> (1,221)
294.77978

>  <PCAT_CMPD_ID> (1,221)
WL-179356

>  <CNC_ID> (1,221)
359353677

>  <transfer_container_id> (1,221)
PTN000000068

>  <COMPOUND_NUMBER> (1,221)
WL-179356

>  <BAR_CODE_NO> (1,221)
3897944

>  <LOCATION_CODE> (1,221)
PTNCS

>  <AMOUNT_CURRENT> (1,221)
33.4

$$$$
WL-180607
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,222)
1504

>  <Formula> (1,222)
C14H19N3S

>  <MolWeight> (1,222)
261.38576

>  <PCAT_CMPD_ID> (1,222)
WL-180607

>  <CNC_ID> (1,222)
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>  <transfer_container_id> (1,222)
PTN000000068

>  <COMPOUND_NUMBER> (1,222)
WL-180607

>  <BAR_CODE_NO> (1,222)
3899054

>  <LOCATION_CODE> (1,222)
PTNCS

>  <AMOUNT_CURRENT> (1,222)
33.4

$$$$
WL-305634
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,223)
1505

>  <Formula> (1,223)
C12H12N4OS

>  <MolWeight> (1,223)
260.31488

>  <PCAT_CMPD_ID> (1,223)
WL-305634

>  <CNC_ID> (1,223)
359353688

>  <transfer_container_id> (1,223)
PTN000000068

>  <COMPOUND_NUMBER> (1,223)
WL-305634

>  <BAR_CODE_NO> (1,223)
3898832

>  <LOCATION_CODE> (1,223)
PTNCS

>  <AMOUNT_CURRENT> (1,223)
33.2

$$$$
CL-148612
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,224)
1506

>  <Formula> (1,224)
C23H21N5O3S

>  <MolWeight> (1,224)
447.50954

>  <PCAT_CMPD_ID> (1,224)
CL-148612

>  <CNC_ID> (1,224)
359353699

>  <transfer_container_id> (1,224)
PTN000000069

>  <COMPOUND_NUMBER> (1,224)
CL-148612

>  <BAR_CODE_NO> (1,224)
2540067

>  <LOCATION_CODE> (1,224)
PTNCS

>  <AMOUNT_CURRENT> (1,224)
32.5

$$$$
CL-17390
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,225)
1507

>  <Formula> (1,225)
C18H14N2O3

>  <MolWeight> (1,225)
306.31536

>  <PCAT_CMPD_ID> (1,225)
CL-17390

>  <CNC_ID> (1,225)
359353703

>  <transfer_container_id> (1,225)
PTN000000069

>  <COMPOUND_NUMBER> (1,225)
CL-17390

>  <BAR_CODE_NO> (1,225)
3900271

>  <LOCATION_CODE> (1,225)
PTNCS

>  <AMOUNT_CURRENT> (1,225)
33.4

$$$$
CL-268388
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,226)
1508

>  <Formula> (1,226)
C19H21NO

>  <MolWeight> (1,226)
279.37614

>  <PCAT_CMPD_ID> (1,226)
CL-268388

>  <CNC_ID> (1,226)
359353712

>  <transfer_container_id> (1,226)
PTN000000069

>  <COMPOUND_NUMBER> (1,226)
CL-268388

>  <BAR_CODE_NO> (1,226)
3900331

>  <LOCATION_CODE> (1,226)
PTNCS

>  <AMOUNT_CURRENT> (1,226)
33.5

$$$$
CL-28786
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,227)
1509

>  <Formula> (1,227)
C15H10Cl2N4

>  <MolWeight> (1,227)
317.1727

>  <PCAT_CMPD_ID> (1,227)
CL-28786

>  <CNC_ID> (1,227)
359353717

>  <transfer_container_id> (1,227)
PTN000000069

>  <COMPOUND_NUMBER> (1,227)
CL-28786

>  <BAR_CODE_NO> (1,227)
3900854

>  <LOCATION_CODE> (1,227)
PTNCS

>  <AMOUNT_CURRENT> (1,227)
33.2

$$$$
CL-309050
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,228)
1510

>  <Formula> (1,228)
C9H9N3OS

>  <MolWeight> (1,228)
207.25226

>  <PCAT_CMPD_ID> (1,228)
CL-309050

>  <CNC_ID> (1,228)
359353719

>  <transfer_container_id> (1,228)
PTN000000069

>  <COMPOUND_NUMBER> (1,228)
CL-309050

>  <BAR_CODE_NO> (1,228)
3900058

>  <LOCATION_CODE> (1,228)
PTNCS

>  <AMOUNT_CURRENT> (1,228)
33.3

$$$$
CL-350222
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,229)
1511

>  <Formula> (1,229)
C19H20N2O5S

>  <MolWeight> (1,229)
388.4375

>  <PCAT_CMPD_ID> (1,229)
CL-350222

>  <CNC_ID> (1,229)
359353728

>  <transfer_container_id> (1,229)
PTN000000069

>  <COMPOUND_NUMBER> (1,229)
CL-350222

>  <BAR_CODE_NO> (1,229)
3900675

>  <LOCATION_CODE> (1,229)
PTNCS

>  <AMOUNT_CURRENT> (1,229)
33.2

$$$$
CL-394739
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,230)
1512

>  <Formula> (1,230)
C26H30N4O2

>  <MolWeight> (1,230)
430.542

>  <PCAT_CMPD_ID> (1,230)
CL-394739

>  <CNC_ID> (1,230)
359353737

>  <transfer_container_id> (1,230)
PTN000000069

>  <COMPOUND_NUMBER> (1,230)
CL-394739

>  <BAR_CODE_NO> (1,230)
3900472

>  <LOCATION_CODE> (1,230)
PTNCS

>  <AMOUNT_CURRENT> (1,230)
33.2

$$$$
CL-402110
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,231)
1513

>  <Formula> (1,231)
C16H12N2O4

>  <MolWeight> (1,231)
296.27748

>  <PCAT_CMPD_ID> (1,231)
CL-402110

>  <CNC_ID> (1,231)
359353741

>  <transfer_container_id> (1,231)
PTN000000069

>  <COMPOUND_NUMBER> (1,231)
CL-402110

>  <BAR_CODE_NO> (1,231)
3900569

>  <LOCATION_CODE> (1,231)
PTNCS

>  <AMOUNT_CURRENT> (1,231)
33.3

$$$$
CL-406156
csChFnd80/10111816222D

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 12 17  2  0  0  0  0
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  5  7  1  0  0  0  0
 11 16  2  0  0  0  0
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,232)
1514

>  <Formula> (1,232)
C19H22N2O2

>  <MolWeight> (1,232)
310.39018

>  <PCAT_CMPD_ID> (1,232)
CL-406156

>  <CNC_ID> (1,232)
359353754

>  <transfer_container_id> (1,232)
PTN000000069

>  <COMPOUND_NUMBER> (1,232)
CL-406156

>  <BAR_CODE_NO> (1,232)
3899913

>  <LOCATION_CODE> (1,232)
PTNCS

>  <AMOUNT_CURRENT> (1,232)
33.4

$$$$
CL-406432
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 20 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7 11  1  0  0  0  0
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  8 13  1  0  0  0  0
 17 19  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,233)
1515

>  <Formula> (1,233)
C20H26N2O2S

>  <MolWeight> (1,233)
358.49764

>  <PCAT_CMPD_ID> (1,233)
CL-406432

>  <CNC_ID> (1,233)
359353755

>  <transfer_container_id> (1,233)
PTN000000069

>  <COMPOUND_NUMBER> (1,233)
CL-406432

>  <BAR_CODE_NO> (1,233)
3901212

>  <LOCATION_CODE> (1,233)
PTNCS

>  <AMOUNT_CURRENT> (1,233)
33.4

$$$$
CL-414657
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 22 25  2  0  0  0  0
  5  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,234)
1516

>  <Formula> (1,234)
C17H15FN2O4S

>  <MolWeight> (1,234)
362.3754032

>  <PCAT_CMPD_ID> (1,234)
CL-414657

>  <CNC_ID> (1,234)
359353768

>  <transfer_container_id> (1,234)
PTN000000069

>  <COMPOUND_NUMBER> (1,234)
CL-414657

>  <BAR_CODE_NO> (1,234)
3901021

>  <LOCATION_CODE> (1,234)
PTNCS

>  <AMOUNT_CURRENT> (1,234)
33

$$$$
CL-415100
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 20  1  0  0  0  0
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 15 22  1  0  0  0  0
 18 23  2  0  0  0  0
 19 24  1  0  0  0  0
  8 12  1  0  0  0  0
 10 14  1  0  0  0  0
 16 22  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,235)
1517

>  <Formula> (1,235)
C18H15N3O3

>  <MolWeight> (1,235)
321.33

>  <PCAT_CMPD_ID> (1,235)
CL-415100

>  <CNC_ID> (1,235)
359353770

>  <transfer_container_id> (1,235)
PTN000000069

>  <COMPOUND_NUMBER> (1,235)
CL-415100

>  <BAR_CODE_NO> (1,235)
3901046

>  <LOCATION_CODE> (1,235)
PTNCS

>  <AMOUNT_CURRENT> (1,235)
33.4

$$$$
CL-416433
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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 22 25  1  0  0  0  0
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M  END
>  <Mol_ID> (1,236)
1518

>  <Formula> (1,236)
C15H17Cl2N3O4S2

>  <MolWeight> (1,236)
438.34918

>  <PCAT_CMPD_ID> (1,236)
CL-416433

>  <CNC_ID> (1,236)
359353778

>  <transfer_container_id> (1,236)
PTN000000069

>  <COMPOUND_NUMBER> (1,236)
CL-416433

>  <BAR_CODE_NO> (1,236)
3900963

>  <LOCATION_CODE> (1,236)
PTNCS

>  <AMOUNT_CURRENT> (1,236)
33.3

$$$$
CL-418243
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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  7  8  1  0  0  0  0
 10 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,237)
1519

>  <Formula> (1,237)
C12H13ClN2O2

>  <MolWeight> (1,237)
252.69682

>  <PCAT_CMPD_ID> (1,237)
CL-418243

>  <CNC_ID> (1,237)
359353790

>  <transfer_container_id> (1,237)
PTN000000069

>  <COMPOUND_NUMBER> (1,237)
CL-418243

>  <BAR_CODE_NO> (1,237)
3900988

>  <LOCATION_CODE> (1,237)
PTNCS

>  <AMOUNT_CURRENT> (1,237)
33.4

$$$$
CL-419274
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10 19  2  0  0  0  0
 16 20  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
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 12 13  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,238)
1520

>  <Formula> (1,238)
C16H15FN2O3S

>  <MolWeight> (1,238)
334.3653032

>  <PCAT_CMPD_ID> (1,238)
CL-419274

>  <CNC_ID> (1,238)
359353792

>  <transfer_container_id> (1,238)
PTN000000069

>  <COMPOUND_NUMBER> (1,238)
CL-419274

>  <BAR_CODE_NO> (1,238)
3900557

>  <LOCATION_CODE> (1,238)
PTNCS

>  <AMOUNT_CURRENT> (1,238)
33.4

$$$$
CL-425158
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,239)
1521

>  <Formula> (1,239)
C13H12INO2

>  <MolWeight> (1,239)
341.14435

>  <PCAT_CMPD_ID> (1,239)
CL-425158

>  <CNC_ID> (1,239)
359353804

>  <transfer_container_id> (1,239)
PTN000000069

>  <COMPOUND_NUMBER> (1,239)
CL-425158

>  <BAR_CODE_NO> (1,239)
3900865

>  <LOCATION_CODE> (1,239)
PTNCS

>  <AMOUNT_CURRENT> (1,239)
33.2

$$$$
CL-5740
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  2  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,240)
1522

>  <Formula> (1,240)
C14H14N4O2

>  <MolWeight> (1,240)
270.28656

>  <PCAT_CMPD_ID> (1,240)
CL-5740

>  <CNC_ID> (1,240)
359353815

>  <transfer_container_id> (1,240)
PTN000000069

>  <COMPOUND_NUMBER> (1,240)
CL-5740

>  <BAR_CODE_NO> (1,240)
3900523

>  <LOCATION_CODE> (1,240)
PTNCS

>  <AMOUNT_CURRENT> (1,240)
33.3

$$$$
GI-557174
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,241)
1523

>  <Formula> (1,241)
C13H13NO2

>  <MolWeight> (1,241)
215.24782

>  <PCAT_CMPD_ID> (1,241)
GI-557174

>  <CNC_ID> (1,241)
359353845

>  <transfer_container_id> (1,241)
PTN000000069

>  <COMPOUND_NUMBER> (1,241)
GI-557174

>  <BAR_CODE_NO> (1,241)
3901184

>  <LOCATION_CODE> (1,241)
PTNCS

>  <AMOUNT_CURRENT> (1,241)
33.3

$$$$
GI-557200
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,242)
1524

>  <Formula> (1,242)
C22H27NO2

>  <MolWeight> (1,242)
337.45528

>  <PCAT_CMPD_ID> (1,242)
GI-557200

>  <CNC_ID> (1,242)
359353846

>  <transfer_container_id> (1,242)
PTN000000069

>  <COMPOUND_NUMBER> (1,242)
GI-557200

>  <BAR_CODE_NO> (1,242)
3901304

>  <LOCATION_CODE> (1,242)
PTNCS

>  <AMOUNT_CURRENT> (1,242)
33.5

$$$$
GI-558712
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,243)
1525

>  <Formula> (1,243)
C18H15ClN4O4S

>  <MolWeight> (1,243)
418.8541

>  <PCAT_CMPD_ID> (1,243)
GI-558712

>  <CNC_ID> (1,243)
359353848

>  <transfer_container_id> (1,243)
PTN000000069

>  <COMPOUND_NUMBER> (1,243)
GI-558712

>  <BAR_CODE_NO> (1,243)
3899537

>  <LOCATION_CODE> (1,243)
PTNCS

>  <AMOUNT_CURRENT> (1,243)
33.4

$$$$
GI-568769
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,244)
1526

>  <Formula> (1,244)
C13H11ClN4

>  <MolWeight> (1,244)
258.70624

>  <PCAT_CMPD_ID> (1,244)
GI-568769

>  <CNC_ID> (1,244)
359353861

>  <transfer_container_id> (1,244)
PTN000000069

>  <COMPOUND_NUMBER> (1,244)
GI-568769

>  <BAR_CODE_NO> (1,244)
3901238

>  <LOCATION_CODE> (1,244)
PTNCS

>  <AMOUNT_CURRENT> (1,244)
33.4

$$$$
SD-219264
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 17 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,245)
1527

>  <Formula> (1,245)
C20H19ClN4O4S

>  <MolWeight> (1,245)
446.90726

>  <PCAT_CMPD_ID> (1,245)
SD-219264

>  <CNC_ID> (1,245)
359353872

>  <transfer_container_id> (1,245)
PTN000000069

>  <COMPOUND_NUMBER> (1,245)
SD-219264

>  <BAR_CODE_NO> (1,245)
3900098

>  <LOCATION_CODE> (1,245)
PTNCS

>  <AMOUNT_CURRENT> (1,245)
33.3

$$$$
WAY-113322
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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M  END
>  <Mol_ID> (1,246)
1528

>  <Formula> (1,246)
C18H19FN2O

>  <MolWeight> (1,246)
298.3546632

>  <PCAT_CMPD_ID> (1,246)
WAY-113322

>  <CNC_ID> (1,246)
359353884

>  <transfer_container_id> (1,246)
PTN000000069

>  <COMPOUND_NUMBER> (1,246)
WAY-113322

>  <BAR_CODE_NO> (1,246)
3900443

>  <LOCATION_CODE> (1,246)
PTNCS

>  <AMOUNT_CURRENT> (1,246)
33.3

$$$$
WAY-113676
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,247)
1529

>  <Formula> (1,247)
C15H11N3O

>  <MolWeight> (1,247)
249.26734

>  <PCAT_CMPD_ID> (1,247)
WAY-113676

>  <CNC_ID> (1,247)
359353888

>  <transfer_container_id> (1,247)
PTN000000069

>  <COMPOUND_NUMBER> (1,247)
WAY-113676

>  <BAR_CODE_NO> (1,247)
3901055

>  <LOCATION_CODE> (1,247)
PTNCS

>  <AMOUNT_CURRENT> (1,247)
33.2

$$$$
WAY-113729
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,248)
1530

>  <Formula> (1,248)
C16H15NO5S

>  <MolWeight> (1,248)
333.359

>  <PCAT_CMPD_ID> (1,248)
WAY-113729

>  <CNC_ID> (1,248)
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>  <transfer_container_id> (1,248)
PTN000000069

>  <COMPOUND_NUMBER> (1,248)
WAY-113729

>  <BAR_CODE_NO> (1,248)
3899312

>  <LOCATION_CODE> (1,248)
PTNCS

>  <AMOUNT_CURRENT> (1,248)
33.4

$$$$
WAY-114004
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,249)
1531

>  <Formula> (1,249)
C17H27NO2

>  <MolWeight> (1,249)
277.40178

>  <PCAT_CMPD_ID> (1,249)
WAY-114004

>  <CNC_ID> (1,249)
359353892

>  <transfer_container_id> (1,249)
PTN000000069

>  <COMPOUND_NUMBER> (1,249)
WAY-114004

>  <BAR_CODE_NO> (1,249)
3899869

>  <LOCATION_CODE> (1,249)
PTNCS

>  <AMOUNT_CURRENT> (1,249)
33.4

$$$$
WAY-115363
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,250)
1532

>  <Formula> (1,250)
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>  <MolWeight> (1,250)
262.10202

>  <PCAT_CMPD_ID> (1,250)
WAY-115363

>  <CNC_ID> (1,250)
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>  <transfer_container_id> (1,250)
PTN000000069

>  <COMPOUND_NUMBER> (1,250)
WAY-115363

>  <BAR_CODE_NO> (1,250)
3901286

>  <LOCATION_CODE> (1,250)
PTNCS

>  <AMOUNT_CURRENT> (1,250)
33.2

$$$$
WAY-115602
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,251)
1533

>  <Formula> (1,251)
C19H15NO2

>  <MolWeight> (1,251)
289.3279

>  <PCAT_CMPD_ID> (1,251)
WAY-115602

>  <CNC_ID> (1,251)
359353916

>  <transfer_container_id> (1,251)
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>  <COMPOUND_NUMBER> (1,251)
WAY-115602

>  <BAR_CODE_NO> (1,251)
3900615

>  <LOCATION_CODE> (1,251)
PTNCS

>  <AMOUNT_CURRENT> (1,251)
33.4

$$$$
WAY-116085
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,252)
1534

>  <Formula> (1,252)
C14H13NO4S

>  <MolWeight> (1,252)
291.32232

>  <PCAT_CMPD_ID> (1,252)
WAY-116085

>  <CNC_ID> (1,252)
359353919

>  <transfer_container_id> (1,252)
PTN000000069

>  <COMPOUND_NUMBER> (1,252)
WAY-116085

>  <BAR_CODE_NO> (1,252)
3899512

>  <LOCATION_CODE> (1,252)
PTNCS

>  <AMOUNT_CURRENT> (1,252)
33.1

$$$$
WAY-243249
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,253)
1535

>  <Formula> (1,253)
C15H22N2O4S

>  <MolWeight> (1,253)
326.41118

>  <PCAT_CMPD_ID> (1,253)
WAY-243249

>  <CNC_ID> (1,253)
359354223

>  <transfer_container_id> (1,253)
PTN000000069

>  <COMPOUND_NUMBER> (1,253)
WAY-243249

>  <BAR_CODE_NO> (1,253)
3901351

>  <LOCATION_CODE> (1,253)
PTNCS

>  <AMOUNT_CURRENT> (1,253)
33.4

$$$$
WAY-298009
csChFnd80/10111816222D

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 21 24  1  0  0  0  0
  7 11  1  0  0  0  0
 17 21  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,254)
1536

>  <Formula> (1,254)
C18H18ClNO4

>  <MolWeight> (1,254)
347.79282

>  <PCAT_CMPD_ID> (1,254)
WAY-298009

>  <CNC_ID> (1,254)
359357003

>  <transfer_container_id> (1,254)
PTN000000069

>  <COMPOUND_NUMBER> (1,254)
WAY-298009

>  <BAR_CODE_NO> (1,254)
3899322

>  <LOCATION_CODE> (1,254)
PTNCS

>  <AMOUNT_CURRENT> (1,254)
33.1

$$$$
WAY-298015
csChFnd80/10111816222D

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 23 26  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,255)
1537

>  <Formula> (1,255)
C20H19F3N4O3

>  <MolWeight> (1,255)
420.3850696

>  <PCAT_CMPD_ID> (1,255)
WAY-298015

>  <CNC_ID> (1,255)
359357009

>  <transfer_container_id> (1,255)
PTN000000069

>  <COMPOUND_NUMBER> (1,255)
WAY-298015

>  <BAR_CODE_NO> (1,255)
3899328

>  <LOCATION_CODE> (1,255)
PTNCS

>  <AMOUNT_CURRENT> (1,255)
33

$$$$
WAY-298023
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,256)
1538

>  <Formula> (1,256)
C17H13ClN2O

>  <MolWeight> (1,256)
296.75092

>  <PCAT_CMPD_ID> (1,256)
WAY-298023

>  <CNC_ID> (1,256)
359357017

>  <transfer_container_id> (1,256)
PTN000000069

>  <COMPOUND_NUMBER> (1,256)
WAY-298023

>  <BAR_CODE_NO> (1,256)
3899338

>  <LOCATION_CODE> (1,256)
PTNCS

>  <AMOUNT_CURRENT> (1,256)
33.4

$$$$
WAY-298026
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 13 15  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,257)
1539

>  <Formula> (1,257)
C19H14FNO

>  <MolWeight> (1,257)
291.3189632

>  <PCAT_CMPD_ID> (1,257)
WAY-298026

>  <CNC_ID> (1,257)
359357020

>  <transfer_container_id> (1,257)
PTN000000069

>  <COMPOUND_NUMBER> (1,257)
WAY-298026

>  <BAR_CODE_NO> (1,257)
3899342

>  <LOCATION_CODE> (1,257)
PTNCS

>  <AMOUNT_CURRENT> (1,257)
33.1

$$$$
WAY-298028
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,258)
1540

>  <Formula> (1,258)
C11H12N4OS

>  <MolWeight> (1,258)
248.30418

>  <PCAT_CMPD_ID> (1,258)
WAY-298028

>  <CNC_ID> (1,258)
359357022

>  <transfer_container_id> (1,258)
PTN000000069

>  <COMPOUND_NUMBER> (1,258)
WAY-298028

>  <BAR_CODE_NO> (1,258)
3899344

>  <LOCATION_CODE> (1,258)
PTNCS

>  <AMOUNT_CURRENT> (1,258)
33.3

$$$$
WAY-298036
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,259)
1541

>  <Formula> (1,259)
C19H22N2O

>  <MolWeight> (1,259)
294.39078

>  <PCAT_CMPD_ID> (1,259)
WAY-298036

>  <CNC_ID> (1,259)
359357030

>  <transfer_container_id> (1,259)
PTN000000069

>  <COMPOUND_NUMBER> (1,259)
WAY-298036

>  <BAR_CODE_NO> (1,259)
3899352

>  <LOCATION_CODE> (1,259)
PTNCS

>  <AMOUNT_CURRENT> (1,259)
33.4

$$$$
WAY-298040
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,260)
1542

>  <Formula> (1,260)
C17H17BrN2O2

>  <MolWeight> (1,260)
361.23308

>  <PCAT_CMPD_ID> (1,260)
WAY-298040

>  <CNC_ID> (1,260)
359357034

>  <transfer_container_id> (1,260)
PTN000000069

>  <COMPOUND_NUMBER> (1,260)
WAY-298040

>  <BAR_CODE_NO> (1,260)
3899358

>  <LOCATION_CODE> (1,260)
PTNCS

>  <AMOUNT_CURRENT> (1,260)
33.2

$$$$
WAY-298046
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,261)
1543

>  <Formula> (1,261)
C17H20N2O3

>  <MolWeight> (1,261)
300.3523

>  <PCAT_CMPD_ID> (1,261)
WAY-298046

>  <CNC_ID> (1,261)
359357040

>  <transfer_container_id> (1,261)
PTN000000069

>  <COMPOUND_NUMBER> (1,261)
WAY-298046

>  <BAR_CODE_NO> (1,261)
3899369

>  <LOCATION_CODE> (1,261)
PTNCS

>  <AMOUNT_CURRENT> (1,261)
33.1

$$$$
WAY-298066
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 23 24  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,262)
1544

>  <Formula> (1,262)
C22H16BrNO5

>  <MolWeight> (1,262)
454.27014

>  <PCAT_CMPD_ID> (1,262)
WAY-298066

>  <CNC_ID> (1,262)
359357060

>  <transfer_container_id> (1,262)
PTN000000069

>  <COMPOUND_NUMBER> (1,262)
WAY-298066

>  <BAR_CODE_NO> (1,262)
3899391

>  <LOCATION_CODE> (1,262)
PTNCS

>  <AMOUNT_CURRENT> (1,262)
33.1

$$$$
WAY-298073
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,263)
1545

>  <Formula> (1,263)
C17H15N3O3

>  <MolWeight> (1,263)
309.3193

>  <PCAT_CMPD_ID> (1,263)
WAY-298073

>  <CNC_ID> (1,263)
359357067

>  <transfer_container_id> (1,263)
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>  <COMPOUND_NUMBER> (1,263)
WAY-298073

>  <BAR_CODE_NO> (1,263)
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>  <LOCATION_CODE> (1,263)
PTNCS

>  <AMOUNT_CURRENT> (1,263)
33.3

$$$$
WAY-298077
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,264)
1546

>  <Formula> (1,264)
C17H21NO

>  <MolWeight> (1,264)
255.35474

>  <PCAT_CMPD_ID> (1,264)
WAY-298077

>  <CNC_ID> (1,264)
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>  <transfer_container_id> (1,264)
PTN000000069

>  <COMPOUND_NUMBER> (1,264)
WAY-298077

>  <BAR_CODE_NO> (1,264)
3899412

>  <LOCATION_CODE> (1,264)
PTNCS

>  <AMOUNT_CURRENT> (1,264)
33.2

$$$$
WAY-298079
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,265)
1547

>  <Formula> (1,265)
C16H15N5O

>  <MolWeight> (1,265)
293.3232

>  <PCAT_CMPD_ID> (1,265)
WAY-298079

>  <CNC_ID> (1,265)
359357073

>  <transfer_container_id> (1,265)
PTN000000069

>  <COMPOUND_NUMBER> (1,265)
WAY-298079

>  <BAR_CODE_NO> (1,265)
3899414

>  <LOCATION_CODE> (1,265)
PTNCS

>  <AMOUNT_CURRENT> (1,265)
33.4

$$$$
WAY-118529-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,266)
1548

>  <Formula> (1,266)
C17H18FN3O

>  <MolWeight> (1,266)
299.3427232

>  <PCAT_CMPD_ID> (1,266)
WAY-118529-A

>  <CNC_ID> (1,266)
359353957

>  <transfer_container_id> (1,266)
PTN000000069

>  <COMPOUND_NUMBER> (1,266)
WAY-118529-A

>  <BAR_CODE_NO> (1,266)
3900631

>  <LOCATION_CODE> (1,266)
PTNCS

>  <AMOUNT_CURRENT> (1,266)
33.4

$$$$
WAY-119171
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,267)
1549

>  <Formula> (1,267)
C18H17N3O5

>  <MolWeight> (1,267)
355.34468

>  <PCAT_CMPD_ID> (1,267)
WAY-119171

>  <CNC_ID> (1,267)
359353977

>  <transfer_container_id> (1,267)
PTN000000069

>  <COMPOUND_NUMBER> (1,267)
WAY-119171

>  <BAR_CODE_NO> (1,267)
3900639

>  <LOCATION_CODE> (1,267)
PTNCS

>  <AMOUNT_CURRENT> (1,267)
33.1

$$$$
WAY-119261
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1,268)
1550

>  <Formula> (1,268)
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>  <MolWeight> (1,268)
231.27366

>  <PCAT_CMPD_ID> (1,268)
WAY-119261

>  <CNC_ID> (1,268)
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>  <transfer_container_id> (1,268)
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>  <COMPOUND_NUMBER> (1,268)
WAY-119261

>  <BAR_CODE_NO> (1,268)
3899541

>  <LOCATION_CODE> (1,268)
PTNCS

>  <AMOUNT_CURRENT> (1,268)
33.3

$$$$
WAY-119939-A
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
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 15  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,269)
1551

>  <Formula> (1,269)
C14H20N2O2

>  <MolWeight> (1,269)
248.3208

>  <PCAT_CMPD_ID> (1,269)
WAY-119939-A

>  <CNC_ID> (1,269)
359353995

>  <transfer_container_id> (1,269)
PTN000000069

>  <COMPOUND_NUMBER> (1,269)
WAY-119939-A

>  <BAR_CODE_NO> (1,269)
3900814

>  <LOCATION_CODE> (1,269)
PTNCS

>  <AMOUNT_CURRENT> (1,269)
33.1

$$$$
WAY-216052-A
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
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 25  7  1  0  0  0  0
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 27 31  2  0  0  0  0
 14 16  2  0  0  0  0
 24 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,270)
1552

>  <Formula> (1,270)
C22H24F3N3O2S

>  <MolWeight> (1,270)
451.5050696

>  <PCAT_CMPD_ID> (1,270)
WAY-216052-A

>  <CNC_ID> (1,270)
359354012

>  <transfer_container_id> (1,270)
PTN000000069

>  <COMPOUND_NUMBER> (1,270)
WAY-216052-A

>  <BAR_CODE_NO> (1,270)
3899366

>  <LOCATION_CODE> (1,270)
PTNCS

>  <AMOUNT_CURRENT> (1,270)
33.2

$$$$
WAY-216355
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  7  2  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
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 17 15  2  0  0  0  0
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 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,271)
1553

>  <Formula> (1,271)
C11H8N2OS3

>  <MolWeight> (1,271)
280.38902

>  <PCAT_CMPD_ID> (1,271)
WAY-216355

>  <CNC_ID> (1,271)
359354013

>  <transfer_container_id> (1,271)
PTN000000069

>  <COMPOUND_NUMBER> (1,271)
WAY-216355

>  <BAR_CODE_NO> (1,271)
3900136

>  <LOCATION_CODE> (1,271)
PTNCS

>  <AMOUNT_CURRENT> (1,271)
33.4

$$$$
WAY-216774
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 11  1  1  0  0  0  0
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 15  9  1  0  0  0  0
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 19 21  1  0  0  0  0
  9 10  2  0  0  0  0
M  END
>  <Mol_ID> (1,272)
1554

>  <Formula> (1,272)
C15H18N2O2S2

>  <MolWeight> (1,272)
322.44562

>  <PCAT_CMPD_ID> (1,272)
WAY-216774

>  <CNC_ID> (1,272)
359354018

>  <transfer_container_id> (1,272)
PTN000000069

>  <COMPOUND_NUMBER> (1,272)
WAY-216774

>  <BAR_CODE_NO> (1,272)
3901164

>  <LOCATION_CODE> (1,272)
PTNCS

>  <AMOUNT_CURRENT> (1,272)
33.1

$$$$
WAY-217244
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,273)
1555

>  <Formula> (1,273)
C11H13N3S2

>  <MolWeight> (1,273)
251.37102

>  <PCAT_CMPD_ID> (1,273)
WAY-217244

>  <CNC_ID> (1,273)
359354021

>  <transfer_container_id> (1,273)
PTN000000069

>  <COMPOUND_NUMBER> (1,273)
WAY-217244

>  <BAR_CODE_NO> (1,273)
3899538

>  <LOCATION_CODE> (1,273)
PTNCS

>  <AMOUNT_CURRENT> (1,273)
33.4

$$$$
WAY-217389
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,274)
1556

>  <Formula> (1,274)
C10H11N3OS

>  <MolWeight> (1,274)
221.27884

>  <PCAT_CMPD_ID> (1,274)
WAY-217389

>  <CNC_ID> (1,274)
359354022

>  <transfer_container_id> (1,274)
PTN000000069

>  <COMPOUND_NUMBER> (1,274)
WAY-217389

>  <BAR_CODE_NO> (1,274)
3899618

>  <LOCATION_CODE> (1,274)
PTNCS

>  <AMOUNT_CURRENT> (1,274)
33.2

$$$$
WAY-217777
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,275)
1557

>  <Formula> (1,275)
C19H22N2O2S2

>  <MolWeight> (1,275)
374.52018

>  <PCAT_CMPD_ID> (1,275)
WAY-217777

>  <CNC_ID> (1,275)
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>  <transfer_container_id> (1,275)
PTN000000069

>  <COMPOUND_NUMBER> (1,275)
WAY-217777

>  <BAR_CODE_NO> (1,275)
3899341

>  <LOCATION_CODE> (1,275)
PTNCS

>  <AMOUNT_CURRENT> (1,275)
28.3

$$$$
WAY-218041
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,276)
1558

>  <Formula> (1,276)
C17H21N3O4

>  <MolWeight> (1,276)
331.36634

>  <PCAT_CMPD_ID> (1,276)
WAY-218041

>  <CNC_ID> (1,276)
359354030

>  <transfer_container_id> (1,276)
PTN000000069

>  <COMPOUND_NUMBER> (1,276)
WAY-218041

>  <BAR_CODE_NO> (1,276)
3899938

>  <LOCATION_CODE> (1,276)
PTNCS

>  <AMOUNT_CURRENT> (1,276)
33.5

$$$$
WAY-218065
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
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 16  7  1  0  0  0  0
 17  1  1  0  0  0  0
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 14 10  1  0  0  0  0
M  END
>  <Mol_ID> (1,277)
1559

>  <Formula> (1,277)
C12H19N3O3

>  <MolWeight> (1,277)
253.29756

>  <PCAT_CMPD_ID> (1,277)
WAY-218065

>  <CNC_ID> (1,277)
359354031

>  <transfer_container_id> (1,277)
PTN000000069

>  <COMPOUND_NUMBER> (1,277)
WAY-218065

>  <BAR_CODE_NO> (1,277)
3900941

>  <LOCATION_CODE> (1,277)
PTNCS

>  <AMOUNT_CURRENT> (1,277)
33.1

$$$$
WAY-218953
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,278)
1560

>  <Formula> (1,278)
C19H25N3O3

>  <MolWeight> (1,278)
343.4201

>  <PCAT_CMPD_ID> (1,278)
WAY-218953

>  <CNC_ID> (1,278)
359354040

>  <transfer_container_id> (1,278)
PTN000000069

>  <COMPOUND_NUMBER> (1,278)
WAY-218953

>  <BAR_CODE_NO> (1,278)
3900776

>  <LOCATION_CODE> (1,278)
PTNCS

>  <AMOUNT_CURRENT> (1,278)
33.2

$$$$
WAY-222764
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,279)
1561

>  <Formula> (1,279)
C18H17NO4

>  <MolWeight> (1,279)
311.33188

>  <PCAT_CMPD_ID> (1,279)
WAY-222764

>  <CNC_ID> (1,279)
359354045

>  <transfer_container_id> (1,279)
PTN000000069

>  <COMPOUND_NUMBER> (1,279)
WAY-222764

>  <BAR_CODE_NO> (1,279)
3900093

>  <LOCATION_CODE> (1,279)
PTNCS

>  <AMOUNT_CURRENT> (1,279)
33.4

$$$$
WAY-225153
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,280)
1562

>  <Formula> (1,280)
C15H15N3O2

>  <MolWeight> (1,280)
269.2985

>  <PCAT_CMPD_ID> (1,280)
WAY-225153

>  <CNC_ID> (1,280)
359354057

>  <transfer_container_id> (1,280)
PTN000000069

>  <COMPOUND_NUMBER> (1,280)
WAY-225153

>  <BAR_CODE_NO> (1,280)
3900107

>  <LOCATION_CODE> (1,280)
PTNCS

>  <AMOUNT_CURRENT> (1,280)
33.1

$$$$
WAY-225456
csChFnd80/10111816222D

 17 17  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
M  END
>  <Mol_ID> (1,281)
1563

>  <Formula> (1,281)
C9H13N3O4S

>  <MolWeight> (1,281)
259.28222

>  <PCAT_CMPD_ID> (1,281)
WAY-225456

>  <CNC_ID> (1,281)
359354058

>  <transfer_container_id> (1,281)
PTN000000069

>  <COMPOUND_NUMBER> (1,281)
WAY-225456

>  <BAR_CODE_NO> (1,281)
3899655

>  <LOCATION_CODE> (1,281)
PTNCS

>  <AMOUNT_CURRENT> (1,281)
33

$$$$
WAY-225568
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 16  6  1  0  0  0  0
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 13 14  1  0  0  0  0
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M  END
>  <Mol_ID> (1,282)
1564

>  <Formula> (1,282)
C18H24N2O4

>  <MolWeight> (1,282)
332.39416

>  <PCAT_CMPD_ID> (1,282)
WAY-225568

>  <CNC_ID> (1,282)
359354059

>  <transfer_container_id> (1,282)
PTN000000069

>  <COMPOUND_NUMBER> (1,282)
WAY-225568

>  <BAR_CODE_NO> (1,282)
3900351

>  <LOCATION_CODE> (1,282)
PTNCS

>  <AMOUNT_CURRENT> (1,282)
33.4

$$$$
WAY-227281
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,283)
1565

>  <Formula> (1,283)
C15H20N2O2

>  <MolWeight> (1,283)
260.3315

>  <PCAT_CMPD_ID> (1,283)
WAY-227281

>  <CNC_ID> (1,283)
359354069

>  <transfer_container_id> (1,283)
PTN000000069

>  <COMPOUND_NUMBER> (1,283)
WAY-227281

>  <BAR_CODE_NO> (1,283)
3900918

>  <LOCATION_CODE> (1,283)
PTNCS

>  <AMOUNT_CURRENT> (1,283)
33.1

$$$$
WAY-228667
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,284)
1566

>  <Formula> (1,284)
C10H10ClN3O2S2

>  <MolWeight> (1,284)
303.7883

>  <PCAT_CMPD_ID> (1,284)
WAY-228667

>  <CNC_ID> (1,284)
359354072

>  <transfer_container_id> (1,284)
PTN000000069

>  <COMPOUND_NUMBER> (1,284)
WAY-228667

>  <BAR_CODE_NO> (1,284)
3899837

>  <LOCATION_CODE> (1,284)
PTNCS

>  <AMOUNT_CURRENT> (1,284)
33.3

$$$$
WAY-229628
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 23 21  2  0  0  0  0
 27 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,285)
1567

>  <Formula> (1,285)
C18H16N4O4S

>  <MolWeight> (1,285)
384.40904

>  <PCAT_CMPD_ID> (1,285)
WAY-229628

>  <CNC_ID> (1,285)
359354074

>  <transfer_container_id> (1,285)
PTN000000069

>  <COMPOUND_NUMBER> (1,285)
WAY-229628

>  <BAR_CODE_NO> (1,285)
3900313

>  <LOCATION_CODE> (1,285)
PTNCS

>  <AMOUNT_CURRENT> (1,285)
33.2

$$$$
WAY-231999
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  4  2  0  0  0  0
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  6  9  1  0  0  0  0
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 11 12  1  0  0  0  0
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 23 24  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,286)
1568

>  <Formula> (1,286)
C18H18BrN3O2

>  <MolWeight> (1,286)
388.25842

>  <PCAT_CMPD_ID> (1,286)
WAY-231999

>  <CNC_ID> (1,286)
359354093

>  <transfer_container_id> (1,286)
PTN000000069

>  <COMPOUND_NUMBER> (1,286)
WAY-231999

>  <BAR_CODE_NO> (1,286)
3900483

>  <LOCATION_CODE> (1,286)
PTNCS

>  <AMOUNT_CURRENT> (1,286)
33.1

$$$$
WAY-233451
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    3.5461    3.6117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.3151    2.3985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
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  7  9  1  0  0  0  0
  8  2  2  0  0  0  0
  9  6  1  0  0  0  0
 10  3  1  0  0  0  0
 11 10  2  0  0  0  0
 12  7  1  0  0  0  0
 13  5  1  0  0  0  0
 14  6  1  0  0  0  0
 15  5  2  0  0  0  0
 16 14  2  0  0  0  0
 17 12  2  0  0  0  0
 18  8  1  0  0  0  0
 19 10  1  0  0  0  0
 20  9  1  0  0  0  0
 21 12  1  0  0  0  0
 16 20  1  0  0  0  0
  7  4  1  0  0  0  0
  8 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,287)
1569

>  <Formula> (1,287)
C13H11ClN2O5

>  <MolWeight> (1,287)
310.68984

>  <PCAT_CMPD_ID> (1,287)
WAY-233451

>  <CNC_ID> (1,287)
359354111

>  <transfer_container_id> (1,287)
PTN000000069

>  <COMPOUND_NUMBER> (1,287)
WAY-233451

>  <BAR_CODE_NO> (1,287)
3900711

>  <LOCATION_CODE> (1,287)
PTNCS

>  <AMOUNT_CURRENT> (1,287)
33.3

$$$$
WAY-233463-A
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  8  2  0  0  0  0
 12  7  2  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  3  1  0  0  0  0
 16  4  1  0  0  0  0
 17  5  1  0  0  0  0
 18 15  1  0  0  0  0
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 20 16  2  0  0  0  0
  3  5  1  0  0  0  0
 19 17  2  0  0  0  0
 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,288)
1570

>  <Formula> (1,288)
C15H15N3O2

>  <MolWeight> (1,288)
269.2985

>  <PCAT_CMPD_ID> (1,288)
WAY-233463-A

>  <CNC_ID> (1,288)
359354112

>  <transfer_container_id> (1,288)
PTN000000069

>  <COMPOUND_NUMBER> (1,288)
WAY-233463-A

>  <BAR_CODE_NO> (1,288)
3899600

>  <LOCATION_CODE> (1,288)
PTNCS

>  <AMOUNT_CURRENT> (1,288)
33.1

$$$$
WAY-233464-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    4.0930    5.9410    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  8  2  0  0  0  0
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 13 10  1  0  0  0  0
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 15  3  1  0  0  0  0
 16  4  1  0  0  0  0
 17  5  1  0  0  0  0
 18 15  1  0  0  0  0
 19 20  1  0  0  0  0
 20 16  2  0  0  0  0
 21 18  1  0  0  0  0
  5  3  1  0  0  0  0
 17 19  2  0  0  0  0
 14 13  2  0  0  0  0
M  END
>  <Mol_ID> (1,289)
1571

>  <Formula> (1,289)
C16H17N3O2

>  <MolWeight> (1,289)
283.32508

>  <PCAT_CMPD_ID> (1,289)
WAY-233464-A

>  <CNC_ID> (1,289)
359354113

>  <transfer_container_id> (1,289)
PTN000000069

>  <COMPOUND_NUMBER> (1,289)
WAY-233464-A

>  <BAR_CODE_NO> (1,289)
3899601

>  <LOCATION_CODE> (1,289)
PTNCS

>  <AMOUNT_CURRENT> (1,289)
33

$$$$
WAY-233509
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    6.1105   -5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  2  0  0  0  0
 11  5  1  0  0  0  0
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 19  2  1  0  0  0  0
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 26 24  1  0  0  0  0
  4  6  1  0  0  0  0
 12 10  1  0  0  0  0
 26 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,290)
1572

>  <Formula> (1,290)
C20H17BrFNO3

>  <MolWeight> (1,290)
418.2562832

>  <PCAT_CMPD_ID> (1,290)
WAY-233509

>  <CNC_ID> (1,290)
359354116

>  <transfer_container_id> (1,290)
PTN000000069

>  <COMPOUND_NUMBER> (1,290)
WAY-233509

>  <BAR_CODE_NO> (1,290)
3899822

>  <LOCATION_CODE> (1,290)
PTNCS

>  <AMOUNT_CURRENT> (1,290)
33.3

$$$$
WAY-233515
csChFnd80/10111816222D

 13 13  0  0  0  0  0  0  0  0999 V2000
    3.1157    3.5578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4654    1.4155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6003    2.2443    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.7981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9989    4.7098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  2  2  0  0  0  0
  8  6  2  0  0  0  0
  9  4  1  0  0  0  0
 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
  4  2  1  0  0  0  0
M  END
>  <Mol_ID> (1,291)
1573

>  <Formula> (1,291)
C8H11NO2S2

>  <MolWeight> (1,291)
217.30844

>  <PCAT_CMPD_ID> (1,291)
WAY-233515

>  <CNC_ID> (1,291)
359354117

>  <transfer_container_id> (1,291)
PTN000000069

>  <COMPOUND_NUMBER> (1,291)
WAY-233515

>  <BAR_CODE_NO> (1,291)
3900242

>  <LOCATION_CODE> (1,291)
PTNCS

>  <AMOUNT_CURRENT> (1,291)
33.1

$$$$
WAY-234032
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    3.8360    1.8030    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.0365    3.0860    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   10.5595   15.9955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10  1  1  0  0  0  0
 11  2  1  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14  7  1  0  0  0  0
 15  7  2  0  0  0  0
 16 14  1  0  0  0  0
 17 20  1  0  0  0  0
 18 16  2  0  0  0  0
 19 16  1  0  0  0  0
 20 19  2  0  0  0  0
 21 18  1  0  0  0  0
 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
 24 13  1  0  0  0  0
 25 13  1  0  0  0  0
 26 17  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 29  1  0  0  0  0
 13 11  1  0  0  0  0
 12  8  1  0  0  0  0
  6  3  1  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,292)
1574

>  <Formula> (1,292)
C23H33NO7

>  <MolWeight> (1,292)
435.51062

>  <PCAT_CMPD_ID> (1,292)
WAY-234032

>  <CNC_ID> (1,292)
359354125

>  <transfer_container_id> (1,292)
PTN000000069

>  <COMPOUND_NUMBER> (1,292)
WAY-234032

>  <BAR_CODE_NO> (1,292)
3900524

>  <LOCATION_CODE> (1,292)
PTNCS

>  <AMOUNT_CURRENT> (1,292)
33.2

$$$$
WAY-234336
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   11.7495   -2.4240    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.9560   -2.4240    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1565   -2.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7 12  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  7  1  0  0  0  0
 11 10  2  0  0  0  0
 12 18  1  0  0  0  0
 13  4  1  0  0  0  0
 14  6  1  0  0  0  0
 15  7  2  0  0  0  0
 16  5  1  0  0  0  0
 17  5  2  0  0  0  0
 18 20  2  0  0  0  0
 19 11  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  2  0  0  0  0
 22 19  2  0  0  0  0
 23 19  1  0  0  0  0
 24 22  1  0  0  0  0
 25 23  2  0  0  0  0
 26 25  1  0  0  0  0
 21 18  1  0  0  0  0
 14 13  2  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,293)
1575

>  <Formula> (1,293)
C18H15N3O3S2

>  <MolWeight> (1,293)
385.46

>  <PCAT_CMPD_ID> (1,293)
WAY-234336

>  <CNC_ID> (1,293)
359354130

>  <transfer_container_id> (1,293)
PTN000000069

>  <COMPOUND_NUMBER> (1,293)
WAY-234336

>  <BAR_CODE_NO> (1,293)
3899650

>  <LOCATION_CODE> (1,293)
PTNCS

>  <AMOUNT_CURRENT> (1,293)
33.1

$$$$
WAY-234384
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -2.9075   -0.0549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1765   -0.0549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  3  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 18 20  1  0  0  0  0
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  5  7  1  0  0  0  0
  9 12  1  0  0  0  0
 21 23  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,294)
1576

>  <Formula> (1,294)
C21H19N3O3S

>  <MolWeight> (1,294)
393.45886

>  <PCAT_CMPD_ID> (1,294)
WAY-234384

>  <CNC_ID> (1,294)
359354131

>  <transfer_container_id> (1,294)
PTN000000069

>  <COMPOUND_NUMBER> (1,294)
WAY-234384

>  <BAR_CODE_NO> (1,294)
3900072

>  <LOCATION_CODE> (1,294)
PTNCS

>  <AMOUNT_CURRENT> (1,294)
33.2

$$$$
WAY-234833
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.5724   -1.5742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
  5  7  1  0  0  0  0
  9 13  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,295)
1577

>  <Formula> (1,295)
C16H18N2O2S

>  <MolWeight> (1,295)
302.39132

>  <PCAT_CMPD_ID> (1,295)
WAY-234833

>  <CNC_ID> (1,295)
359354137

>  <transfer_container_id> (1,295)
PTN000000069

>  <COMPOUND_NUMBER> (1,295)
WAY-234833

>  <BAR_CODE_NO> (1,295)
3900979

>  <LOCATION_CODE> (1,295)
PTNCS

>  <AMOUNT_CURRENT> (1,295)
33.3

$$$$
WAY-234988
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,296)
1578

>  <Formula> (1,296)
C17H19N3O

>  <MolWeight> (1,296)
281.35226

>  <PCAT_CMPD_ID> (1,296)
WAY-234988

>  <CNC_ID> (1,296)
359354142

>  <transfer_container_id> (1,296)
PTN000000069

>  <COMPOUND_NUMBER> (1,296)
WAY-234988

>  <BAR_CODE_NO> (1,296)
3899934

>  <LOCATION_CODE> (1,296)
PTNCS

>  <AMOUNT_CURRENT> (1,296)
30.2

$$$$
WAY-236290-A
csChFnd80/10111816222D

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 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,297)
1579

>  <Formula> (1,297)
C17H18BrN3O

>  <MolWeight> (1,297)
360.24832

>  <PCAT_CMPD_ID> (1,297)
WAY-236290-A

>  <CNC_ID> (1,297)
359354149

>  <transfer_container_id> (1,297)
PTN000000069

>  <COMPOUND_NUMBER> (1,297)
WAY-236290-A

>  <BAR_CODE_NO> (1,297)
3899627

>  <LOCATION_CODE> (1,297)
PTNCS

>  <AMOUNT_CURRENT> (1,297)
33.2

$$$$
WAY-231670
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,298)
1051

>  <Formula> (1,298)
C11H10FNO3S

>  <MolWeight> (1,298)
255.2654032

>  <PCAT_CMPD_ID> (1,298)
WAY-231670

>  <CNC_ID> (1,298)
359326890

>  <transfer_container_id> (1,298)
PTN000000067

>  <COMPOUND_NUMBER> (1,298)
WAY-231670

>  <BAR_CODE_NO> (1,298)
3918169

>  <LOCATION_CODE> (1,298)
PTNCS

>  <AMOUNT_CURRENT> (1,298)
33.3

$$$$
CL-394792
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,299)
1052

>  <Formula> (1,299)
C11H14N2O2S

>  <MolWeight> (1,299)
238.30606

>  <PCAT_CMPD_ID> (1,299)
CL-394792

>  <CNC_ID> (1,299)
359313584

>  <transfer_container_id> (1,299)
PTN000000065

>  <COMPOUND_NUMBER> (1,299)
CL-394792

>  <BAR_CODE_NO> (1,299)
3916699

>  <LOCATION_CODE> (1,299)
PTNCS

>  <AMOUNT_CURRENT> (1,299)
33.2

$$$$
WAY-311250
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,300)
1053

>  <Formula> (1,300)
C14H17NO3S

>  <MolWeight> (1,300)
279.35468

>  <PCAT_CMPD_ID> (1,300)
WAY-311250

>  <CNC_ID> (1,300)
359314991

>  <transfer_container_id> (1,300)
PTN000000065

>  <COMPOUND_NUMBER> (1,300)
WAY-311250

>  <BAR_CODE_NO> (1,300)
3915620

>  <LOCATION_CODE> (1,300)
PTNCS

>  <AMOUNT_CURRENT> (1,300)
33.5

$$$$
WAY-215750
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1,301)
1054

>  <Formula> (1,301)
C13H15NO4S

>  <MolWeight> (1,301)
281.3275

>  <PCAT_CMPD_ID> (1,301)
WAY-215750

>  <CNC_ID> (1,301)
359313769

>  <transfer_container_id> (1,301)
PTN000000065

>  <COMPOUND_NUMBER> (1,301)
WAY-215750

>  <BAR_CODE_NO> (1,301)
3914770

>  <LOCATION_CODE> (1,301)
PTNCS

>  <AMOUNT_CURRENT> (1,301)
33.9

$$$$
WAY-345212
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,302)
1055

>  <Formula> (1,302)
C12H11BrN2O2S

>  <MolWeight> (1,302)
327.19694

>  <PCAT_CMPD_ID> (1,302)
WAY-345212

>  <CNC_ID> (1,302)
359320514

>  <transfer_container_id> (1,302)
PTN000000065

>  <COMPOUND_NUMBER> (1,302)
WAY-345212

>  <BAR_CODE_NO> (1,302)
2555732

>  <LOCATION_CODE> (1,302)
PTNCS

>  <AMOUNT_CURRENT> (1,302)
32.3

$$$$
WAY-330076
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
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  5  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,303)
1056

>  <Formula> (1,303)
C12H11N3O2S

>  <MolWeight> (1,303)
261.29964

>  <PCAT_CMPD_ID> (1,303)
WAY-330076

>  <CNC_ID> (1,303)
359317441

>  <transfer_container_id> (1,303)
PTN000000076

>  <COMPOUND_NUMBER> (1,303)
WAY-330076

>  <BAR_CODE_NO> (1,303)
2572706

>  <LOCATION_CODE> (1,303)
PTNCS

>  <AMOUNT_CURRENT> (1,303)
32.6

$$$$
WAY-312005
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 11  8  2  0  0  0  0
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 13  7  1  0  0  0  0
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 21 15  2  0  0  0  0
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 24  5  1  0  0  0  0
 25  6  1  0  0  0  0
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  2  6  1  0  0  0  0
 18 22  2  0  0  0  0
 25 28  2  0  0  0  0
 10 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,304)
1057

>  <Formula> (1,304)
C22H18N4O2

>  <MolWeight> (1,304)
370.40392

>  <PCAT_CMPD_ID> (1,304)
WAY-312005

>  <CNC_ID> (1,304)
359315746

>  <transfer_container_id> (1,304)
PTN000000065

>  <COMPOUND_NUMBER> (1,304)
WAY-312005

>  <BAR_CODE_NO> (1,304)
3916558

>  <LOCATION_CODE> (1,304)
PTNCS

>  <AMOUNT_CURRENT> (1,304)
33.2

$$$$
WAY-311283
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 16 18  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,305)
1058

>  <Formula> (1,305)
C22H18N4O2

>  <MolWeight> (1,305)
370.40392

>  <PCAT_CMPD_ID> (1,305)
WAY-311283

>  <CNC_ID> (1,305)
359315024

>  <transfer_container_id> (1,305)
PTN000000065

>  <COMPOUND_NUMBER> (1,305)
WAY-311283

>  <BAR_CODE_NO> (1,305)
3915654

>  <LOCATION_CODE> (1,305)
PTNCS

>  <AMOUNT_CURRENT> (1,305)
33.5

$$$$
WAY-311172
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 16 18  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,306)
1059

>  <Formula> (1,306)
C23H21N5O3S

>  <MolWeight> (1,306)
447.50954

>  <PCAT_CMPD_ID> (1,306)
WAY-311172

>  <CNC_ID> (1,306)
359314913

>  <transfer_container_id> (1,306)
PTN000000065

>  <COMPOUND_NUMBER> (1,306)
WAY-311172

>  <BAR_CODE_NO> (1,306)
3915534

>  <LOCATION_CODE> (1,306)
PTNCS

>  <AMOUNT_CURRENT> (1,306)
33.6

$$$$
WAY-314667
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,307)
1060

>  <Formula> (1,307)
C16H14N2S

>  <MolWeight> (1,307)
266.36076

>  <PCAT_CMPD_ID> (1,307)
WAY-314667

>  <CNC_ID> (1,307)
359329704

>  <transfer_container_id> (1,307)
PTN000000067

>  <COMPOUND_NUMBER> (1,307)
WAY-314667

>  <BAR_CODE_NO> (1,307)
1364314

>  <LOCATION_CODE> (1,307)
PTNCS

>  <AMOUNT_CURRENT> (1,307)
33

$$$$
WAY-312305
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
M  END
>  <Mol_ID> (1,308)
1061

>  <Formula> (1,308)
C12H11NO2

>  <MolWeight> (1,308)
201.22124

>  <PCAT_CMPD_ID> (1,308)
WAY-312305

>  <CNC_ID> (1,308)
359316045

>  <transfer_container_id> (1,308)
PTN000000065

>  <COMPOUND_NUMBER> (1,308)
WAY-312305

>  <BAR_CODE_NO> (1,308)
3916925

>  <LOCATION_CODE> (1,308)
PTNCS

>  <AMOUNT_CURRENT> (1,308)
33.8

$$$$
WAY-310790
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
 13 15  2  0  0  0  0
 21 22  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,309)
1062

>  <Formula> (1,309)
C21H23N3O4

>  <MolWeight> (1,309)
381.42502

>  <PCAT_CMPD_ID> (1,309)
WAY-310790

>  <CNC_ID> (1,309)
359314531

>  <transfer_container_id> (1,309)
PTN000000065

>  <COMPOUND_NUMBER> (1,309)
WAY-310790

>  <BAR_CODE_NO> (1,309)
3915064

>  <LOCATION_CODE> (1,309)
PTNCS

>  <AMOUNT_CURRENT> (1,309)
33.2

$$$$
WAY-310826
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
 15 19  1  0  0  0  0
 17 20  1  0  0  0  0
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M  END
>  <Mol_ID> (1,310)
1063

>  <Formula> (1,310)
C20H16N4S

>  <MolWeight> (1,310)
344.43284

>  <PCAT_CMPD_ID> (1,310)
WAY-310826

>  <CNC_ID> (1,310)
359314568

>  <transfer_container_id> (1,310)
PTN000000065

>  <COMPOUND_NUMBER> (1,310)
WAY-310826

>  <BAR_CODE_NO> (1,310)
3915106

>  <LOCATION_CODE> (1,310)
PTNCS

>  <AMOUNT_CURRENT> (1,310)
33

$$$$
WAY-234504
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,311)
1064

>  <Formula> (1,311)
C15H13N3O

>  <MolWeight> (1,311)
251.28322

>  <PCAT_CMPD_ID> (1,311)
WAY-234504

>  <CNC_ID> (1,311)
359326903

>  <transfer_container_id> (1,311)
PTN000000067

>  <COMPOUND_NUMBER> (1,311)
WAY-234504

>  <BAR_CODE_NO> (1,311)
3917795

>  <LOCATION_CODE> (1,311)
PTNCS

>  <AMOUNT_CURRENT> (1,311)
33.3

$$$$
WAY-311914
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,312)
1065

>  <Formula> (1,312)
C17H17NO4

>  <MolWeight> (1,312)
299.32118

>  <PCAT_CMPD_ID> (1,312)
WAY-311914

>  <CNC_ID> (1,312)
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>  <transfer_container_id> (1,312)
PTN000000065

>  <COMPOUND_NUMBER> (1,312)
WAY-311914

>  <BAR_CODE_NO> (1,312)
3916442

>  <LOCATION_CODE> (1,312)
PTNCS

>  <AMOUNT_CURRENT> (1,312)
33.3

$$$$
GI-514969
csChFnd80/10111816222D

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 11 15  2  0  0  0  0
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 14 17  2  0  0  0  0
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M  END
>  <Mol_ID> (1,313)
1066

>  <Formula> (1,313)
C14H11N3S

>  <MolWeight> (1,313)
253.32224

>  <PCAT_CMPD_ID> (1,313)
GI-514969

>  <CNC_ID> (1,313)
359326773

>  <transfer_container_id> (1,313)
PTN000000067

>  <COMPOUND_NUMBER> (1,313)
GI-514969

>  <BAR_CODE_NO> (1,313)
3918017

>  <LOCATION_CODE> (1,313)
PTNCS

>  <AMOUNT_CURRENT> (1,313)
33.2

$$$$
WAY-310813
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,314)
1067

>  <Formula> (1,314)
C15H14N2O5S

>  <MolWeight> (1,314)
334.34706

>  <PCAT_CMPD_ID> (1,314)
WAY-310813

>  <CNC_ID> (1,314)
359314554

>  <transfer_container_id> (1,314)
PTN000000065

>  <COMPOUND_NUMBER> (1,314)
WAY-310813

>  <BAR_CODE_NO> (1,314)
3915092

>  <LOCATION_CODE> (1,314)
PTNCS

>  <AMOUNT_CURRENT> (1,314)
33.2

$$$$
WAY-345534
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,315)
1068

>  <Formula> (1,315)
C21H16FN3O4S

>  <MolWeight> (1,315)
425.4328432

>  <PCAT_CMPD_ID> (1,315)
WAY-345534

>  <CNC_ID> (1,315)
359320796

>  <transfer_container_id> (1,315)
PTN000000065

>  <COMPOUND_NUMBER> (1,315)
WAY-345534

>  <BAR_CODE_NO> (1,315)
2555785

>  <LOCATION_CODE> (1,315)
PTNCS

>  <AMOUNT_CURRENT> (1,315)
33

$$$$
WAY-310924-A
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1,316)
1069

>  <Formula> (1,316)
C21H23N3O4S

>  <MolWeight> (1,316)
413.49002

>  <PCAT_CMPD_ID> (1,316)
WAY-310924-A

>  <CNC_ID> (1,316)
359314666

>  <transfer_container_id> (1,316)
PTN000000065

>  <COMPOUND_NUMBER> (1,316)
WAY-310924-A

>  <BAR_CODE_NO> (1,316)
3915226

>  <LOCATION_CODE> (1,316)
PTNCS

>  <AMOUNT_CURRENT> (1,316)
33.3

$$$$
WAY-313004
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  9 11  1  0  0  0  0
 16 17  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,317)
1070

>  <Formula> (1,317)
C17H20N2O3S

>  <MolWeight> (1,317)
332.4173

>  <PCAT_CMPD_ID> (1,317)
WAY-313004

>  <CNC_ID> (1,317)
359328041

>  <transfer_container_id> (1,317)
PTN000000067

>  <COMPOUND_NUMBER> (1,317)
WAY-313004

>  <BAR_CODE_NO> (1,317)
3917773

>  <LOCATION_CODE> (1,317)
PTNCS

>  <AMOUNT_CURRENT> (1,317)
33.3

$$$$
WAY-314481
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 14  3  0  0  0  0
 13 15  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,318)
1071

>  <Formula> (1,318)
C16H17N3O

>  <MolWeight> (1,318)
267.32568

>  <PCAT_CMPD_ID> (1,318)
WAY-314481

>  <CNC_ID> (1,318)
359329517

>  <transfer_container_id> (1,318)
PTN000000067

>  <COMPOUND_NUMBER> (1,318)
WAY-314481

>  <BAR_CODE_NO> (1,318)
1364128

>  <LOCATION_CODE> (1,318)
PTNCS

>  <AMOUNT_CURRENT> (1,318)
33

$$$$
WAY-311204
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 14  3  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,319)
1072

>  <Formula> (1,319)
C17H19N3O2

>  <MolWeight> (1,319)
297.35166

>  <PCAT_CMPD_ID> (1,319)
WAY-311204

>  <CNC_ID> (1,319)
359314945

>  <transfer_container_id> (1,319)
PTN000000065

>  <COMPOUND_NUMBER> (1,319)
WAY-311204

>  <BAR_CODE_NO> (1,319)
3915568

>  <LOCATION_CODE> (1,319)
PTNCS

>  <AMOUNT_CURRENT> (1,319)
33.8

$$$$
WAY-343866
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 15  1  0  0  0  0
 13  6  2  0  0  0  0
 14 11  1  0  0  0  0
 15  8  1  0  0  0  0
 16  7  2  0  0  0  0
 17 10  2  0  0  0  0
 18 17  1  0  0  0  0
 19  8  2  0  0  0  0
 20  3  1  0  0  0  0
 21  5  1  0  0  0  0
 22 13  1  0  0  0  0
 23  6  1  0  0  0  0
 24 13  1  0  0  0  0
 25 23  2  0  0  0  0
 26 25  1  0  0  0  0
  4  2  1  0  0  0  0
 14 18  2  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,320)
1073

>  <Formula> (1,320)
C20H19NO4S

>  <MolWeight> (1,320)
369.43416

>  <PCAT_CMPD_ID> (1,320)
WAY-343866

>  <CNC_ID> (1,320)
359319207

>  <transfer_container_id> (1,320)
PTN000000065

>  <COMPOUND_NUMBER> (1,320)
WAY-343866

>  <BAR_CODE_NO> (1,320)
2554030

>  <LOCATION_CODE> (1,320)
PTNCS

>  <AMOUNT_CURRENT> (1,320)
26.7

$$$$
WAY-311662
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 13  2  0  0  0  0
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 14 16  1  0  0  0  0
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 18 20  1  0  0  0  0
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 19 22  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,321)
1074

>  <Formula> (1,321)
C18H16N2O2

>  <MolWeight> (1,321)
292.33184

>  <PCAT_CMPD_ID> (1,321)
WAY-311662

>  <CNC_ID> (1,321)
359315403

>  <transfer_container_id> (1,321)
PTN000000065

>  <COMPOUND_NUMBER> (1,321)
WAY-311662

>  <BAR_CODE_NO> (1,321)
3916109

>  <LOCATION_CODE> (1,321)
PTNCS

>  <AMOUNT_CURRENT> (1,321)
33.1

$$$$
WAY-312118
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  7 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 17 20  1  0  0  0  0
  6  8  1  0  0  0  0
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,322)
1075

>  <Formula> (1,322)
C15H10O4S

>  <MolWeight> (1,322)
286.3025

>  <PCAT_CMPD_ID> (1,322)
WAY-312118

>  <CNC_ID> (1,322)
359315858

>  <transfer_container_id> (1,322)
PTN000000065

>  <COMPOUND_NUMBER> (1,322)
WAY-312118

>  <BAR_CODE_NO> (1,322)
3916695

>  <LOCATION_CODE> (1,322)
PTNCS

>  <AMOUNT_CURRENT> (1,322)
33.4

$$$$
CL-408860
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    6.9236    6.9584    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  3  0  0  0  0
 17 19  3  0  0  0  0
  5  9  1  0  0  0  0
 11 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,323)
1076

>  <Formula> (1,323)
C14H7N5

>  <MolWeight> (1,323)
245.23888

>  <PCAT_CMPD_ID> (1,323)
CL-408860

>  <CNC_ID> (1,323)
359326730

>  <transfer_container_id> (1,323)
PTN000000067

>  <COMPOUND_NUMBER> (1,323)
CL-408860

>  <BAR_CODE_NO> (1,323)
3917890

>  <LOCATION_CODE> (1,323)
PTNCS

>  <AMOUNT_CURRENT> (1,323)
33.9

$$$$
WAY-344962
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   13.8917   -5.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -3.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  9  1  0  0  0  0
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  7  6  2  0  0  0  0
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  9 12  1  0  0  0  0
 10  3  1  0  0  0  0
 11  2  1  0  0  0  0
 12 15  1  0  0  0  0
 13  5  2  0  0  0  0
 14  8  2  0  0  0  0
 15 10  2  0  0  0  0
 16  1  1  0  0  0  0
 17  8  1  0  0  0  0
 18  4  2  0  0  0  0
 19  6  1  0  0  0  0
 20  7  1  0  0  0  0
 21 14  1  0  0  0  0
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 25 21  1  0  0  0  0
 26 16  1  0  0  0  0
 27 28  1  0  0  0  0
 28 19  2  0  0  0  0
  7  2  1  0  0  0  0
 20 27  2  0  0  0  0
 12 11  2  0  0  0  0
 23 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,324)
1077

>  <Formula> (1,324)
C23H22N2O3

>  <MolWeight> (1,324)
374.43238

>  <PCAT_CMPD_ID> (1,324)
WAY-344962

>  <CNC_ID> (1,324)
359320273

>  <transfer_container_id> (1,324)
PTN000000065

>  <COMPOUND_NUMBER> (1,324)
WAY-344962

>  <BAR_CODE_NO> (1,324)
2555211

>  <LOCATION_CODE> (1,324)
PTNCS

>  <AMOUNT_CURRENT> (1,324)
32.4

$$$$
WAY-117180
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    0.5440    1.1933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5 10  1  0  0  0  0
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 10 12  1  0  0  0  0
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 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
  9 11  1  0  0  0  0
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M  END
>  <Mol_ID> (1,325)
1078

>  <Formula> (1,325)
C11H9FN2O2S

>  <MolWeight> (1,325)
252.2647632

>  <PCAT_CMPD_ID> (1,325)
WAY-117180

>  <CNC_ID> (1,325)
359313720

>  <transfer_container_id> (1,325)
PTN000000065

>  <COMPOUND_NUMBER> (1,325)
WAY-117180

>  <BAR_CODE_NO> (1,325)
3917036

>  <LOCATION_CODE> (1,325)
PTNCS

>  <AMOUNT_CURRENT> (1,325)
33.8

$$$$
WAY-239279
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  4  1  0  0  0  0
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 13  9  1  0  0  0  0
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 15  3  1  0  0  0  0
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 13 12  2  0  0  0  0
 17  6  1  0  0  0  0
M  END
>  <Mol_ID> (1,326)
1079

>  <Formula> (1,326)
C11H8F3NO2S2

>  <MolWeight> (1,326)
307.3119296

>  <PCAT_CMPD_ID> (1,326)
WAY-239279

>  <CNC_ID> (1,326)
359313963

>  <transfer_container_id> (1,326)
PTN000000065

>  <COMPOUND_NUMBER> (1,326)
WAY-239279

>  <BAR_CODE_NO> (1,326)
3914989

>  <LOCATION_CODE> (1,326)
PTNCS

>  <AMOUNT_CURRENT> (1,326)
33.1

$$$$
WAY-312308
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10 14  2  0  0  0  0
 10 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 15 18  2  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
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 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
  8 13  1  0  0  0  0
 18 19  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (1,327)
1080

>  <Formula> (1,327)
C20H20N2O3S2

>  <MolWeight> (1,327)
400.5144

>  <PCAT_CMPD_ID> (1,327)
WAY-312308

>  <CNC_ID> (1,327)
359316048

>  <transfer_container_id> (1,327)
PTN000000065

>  <COMPOUND_NUMBER> (1,327)
WAY-312308

>  <BAR_CODE_NO> (1,327)
3916928

>  <LOCATION_CODE> (1,327)
PTNCS

>  <AMOUNT_CURRENT> (1,327)
33.7

$$$$
WAY-344224
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   13.0917   -5.6542    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  2  0  0  0  0
  6  7  1  0  0  0  0
  7 11  1  0  0  0  0
  8 25  1  0  0  0  0
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 10  3  1  0  0  0  0
 11 10  2  0  0  0  0
 12  9  1  0  0  0  0
 13  2  1  0  0  0  0
 14 19  2  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
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 21  6  1  0  0  0  0
 22  6  1  0  0  0  0
 23  6  1  0  0  0  0
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 27 20  1  0  0  0  0
 12  7  2  0  0  0  0
 14 18  1  0  0  0  0
  8 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,328)
1081

>  <Formula> (1,328)
C22H24N2O2S

>  <MolWeight> (1,328)
380.50316

>  <PCAT_CMPD_ID> (1,328)
WAY-344224

>  <CNC_ID> (1,328)
359319798

>  <transfer_container_id> (1,328)
PTN000000065

>  <COMPOUND_NUMBER> (1,328)
WAY-344224

>  <BAR_CODE_NO> (1,328)
2554572

>  <LOCATION_CODE> (1,328)
PTNCS

>  <AMOUNT_CURRENT> (1,328)
32.6

$$$$
WAY-310480
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
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 11 12  1  0  0  0  0
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 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,329)
1082

>  <Formula> (1,329)
C14H13NO4S

>  <MolWeight> (1,329)
291.32232

>  <PCAT_CMPD_ID> (1,329)
WAY-310480

>  <CNC_ID> (1,329)
359314221

>  <transfer_container_id> (1,329)
PTN000000065

>  <COMPOUND_NUMBER> (1,329)
WAY-310480

>  <BAR_CODE_NO> (1,329)
3914702

>  <LOCATION_CODE> (1,329)
PTNCS

>  <AMOUNT_CURRENT> (1,329)
33.7

$$$$
WAY-345079
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,330)
1083

>  <Formula> (1,330)
C10H10N2OS

>  <MolWeight> (1,330)
206.2642

>  <PCAT_CMPD_ID> (1,330)
WAY-345079

>  <CNC_ID> (1,330)
359320389

>  <transfer_container_id> (1,330)
PTN000000065

>  <COMPOUND_NUMBER> (1,330)
WAY-345079

>  <BAR_CODE_NO> (1,330)
2555401

>  <LOCATION_CODE> (1,330)
PTNCS

>  <AMOUNT_CURRENT> (1,330)
32.3

$$$$
WAY-344225
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.9792   -5.6042    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 11  9  2  0  0  0  0
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 15  8  1  0  0  0  0
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M  END
>  <Mol_ID> (1,331)
1084

>  <Formula> (1,331)
C18H14Cl2N2O2S

>  <MolWeight> (1,331)
393.28696

>  <PCAT_CMPD_ID> (1,331)
WAY-344225

>  <CNC_ID> (1,331)
359320051

>  <transfer_container_id> (1,331)
PTN000000065

>  <COMPOUND_NUMBER> (1,331)
WAY-344225

>  <BAR_CODE_NO> (1,331)
2554573

>  <LOCATION_CODE> (1,331)
PTNCS

>  <AMOUNT_CURRENT> (1,331)
33

$$$$
WAY-312286
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 12 13  2  0  0  0  0
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M  END
>  <Mol_ID> (1,332)
1085

>  <Formula> (1,332)
C16H13BrN2O4S

>  <MolWeight> (1,332)
409.25442

>  <PCAT_CMPD_ID> (1,332)
WAY-312286

>  <CNC_ID> (1,332)
359316026

>  <transfer_container_id> (1,332)
PTN000000065

>  <COMPOUND_NUMBER> (1,332)
WAY-312286

>  <BAR_CODE_NO> (1,332)
3916901

>  <LOCATION_CODE> (1,332)
PTNCS

>  <AMOUNT_CURRENT> (1,332)
33.2

$$$$
WAY-345128
csChFnd80/10111816222D

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 18 10  2  0  0  0  0
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M  END
>  <Mol_ID> (1,333)
1086

>  <Formula> (1,333)
C24H20N2O7S

>  <MolWeight> (1,333)
480.4898

>  <PCAT_CMPD_ID> (1,333)
WAY-345128

>  <CNC_ID> (1,333)
359320431

>  <transfer_container_id> (1,333)
PTN000000065

>  <COMPOUND_NUMBER> (1,333)
WAY-345128

>  <BAR_CODE_NO> (1,333)
2555404

>  <LOCATION_CODE> (1,333)
PTNCS

>  <AMOUNT_CURRENT> (1,333)
32.2

$$$$
WAY-311082
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,334)
1087

>  <Formula> (1,334)
C19H12N2O4

>  <MolWeight> (1,334)
332.30958

>  <PCAT_CMPD_ID> (1,334)
WAY-311082

>  <CNC_ID> (1,334)
359314824

>  <transfer_container_id> (1,334)
PTN000000065

>  <COMPOUND_NUMBER> (1,334)
WAY-311082

>  <BAR_CODE_NO> (1,334)
3915429

>  <LOCATION_CODE> (1,334)
PTNCS

>  <AMOUNT_CURRENT> (1,334)
33.6

$$$$
WAY-313126
csChFnd80/10111816222D

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 13  7  2  0  0  0  0
M  END
>  <Mol_ID> (1,335)
1088

>  <Formula> (1,335)
C14H10BrN3O4S2

>  <MolWeight> (1,335)
428.2809

>  <PCAT_CMPD_ID> (1,335)
WAY-313126

>  <CNC_ID> (1,335)
359328162

>  <transfer_container_id> (1,335)
PTN000000067

>  <COMPOUND_NUMBER> (1,335)
WAY-313126

>  <BAR_CODE_NO> (1,335)
3917927

>  <LOCATION_CODE> (1,335)
PTNCS

>  <AMOUNT_CURRENT> (1,335)
33.7

$$$$
WAY-311734
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,336)
1089

>  <Formula> (1,336)
C19H16N4OS

>  <MolWeight> (1,336)
348.42154

>  <PCAT_CMPD_ID> (1,336)
WAY-311734

>  <CNC_ID> (1,336)
359315475

>  <transfer_container_id> (1,336)
PTN000000065

>  <COMPOUND_NUMBER> (1,336)
WAY-311734

>  <BAR_CODE_NO> (1,336)
3916212

>  <LOCATION_CODE> (1,336)
PTNCS

>  <AMOUNT_CURRENT> (1,336)
33.9

$$$$
WAY-313204
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,337)
1090

>  <Formula> (1,337)
C19H15N3OS

>  <MolWeight> (1,337)
333.4069

>  <PCAT_CMPD_ID> (1,337)
WAY-313204

>  <CNC_ID> (1,337)
359328240

>  <transfer_container_id> (1,337)
PTN000000067

>  <COMPOUND_NUMBER> (1,337)
WAY-313204

>  <BAR_CODE_NO> (1,337)
3918028

>  <LOCATION_CODE> (1,337)
PTNCS

>  <AMOUNT_CURRENT> (1,337)
33.1

$$$$
WAY-311389
csChFnd80/10111816222D

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 22 24  1  0  0  0  0
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 13 20  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,338)
1091

>  <Formula> (1,338)
C19H23NO3S

>  <MolWeight> (1,338)
345.45582

>  <PCAT_CMPD_ID> (1,338)
WAY-311389

>  <CNC_ID> (1,338)
359315130

>  <transfer_container_id> (1,338)
PTN000000065

>  <COMPOUND_NUMBER> (1,338)
WAY-311389

>  <BAR_CODE_NO> (1,338)
3915768

>  <LOCATION_CODE> (1,338)
PTNCS

>  <AMOUNT_CURRENT> (1,338)
33.4

$$$$
WAY-314211
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,339)
1092

>  <Formula> (1,339)
C20H19N3O3

>  <MolWeight> (1,339)
349.38316

>  <PCAT_CMPD_ID> (1,339)
WAY-314211

>  <CNC_ID> (1,339)
359329247

>  <transfer_container_id> (1,339)
PTN000000067

>  <COMPOUND_NUMBER> (1,339)
WAY-314211

>  <BAR_CODE_NO> (1,339)
1363857

>  <LOCATION_CODE> (1,339)
PTNCS

>  <AMOUNT_CURRENT> (1,339)
33

$$$$
WAY-311287
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,340)
1093

>  <Formula> (1,340)
C28H29NO4

>  <MolWeight> (1,340)
443.53416

>  <PCAT_CMPD_ID> (1,340)
WAY-311287

>  <CNC_ID> (1,340)
359315028

>  <transfer_container_id> (1,340)
PTN000000065

>  <COMPOUND_NUMBER> (1,340)
WAY-311287

>  <BAR_CODE_NO> (1,340)
3915658

>  <LOCATION_CODE> (1,340)
PTNCS

>  <AMOUNT_CURRENT> (1,340)
33.1

$$$$
WAY-312779-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,341)
1094

>  <Formula> (1,341)
C23H29N3O3

>  <MolWeight> (1,341)
395.49466

>  <PCAT_CMPD_ID> (1,341)
WAY-312779-A

>  <CNC_ID> (1,341)
359327816

>  <transfer_container_id> (1,341)
PTN000000067

>  <COMPOUND_NUMBER> (1,341)
WAY-312779-A

>  <BAR_CODE_NO> (1,341)
3917485

>  <LOCATION_CODE> (1,341)
PTNCS

>  <AMOUNT_CURRENT> (1,341)
33.4

$$$$
WAY-311386
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,342)
1095

>  <Formula> (1,342)
C18H24N2O2

>  <MolWeight> (1,342)
300.39536

>  <PCAT_CMPD_ID> (1,342)
WAY-311386

>  <CNC_ID> (1,342)
359315127

>  <transfer_container_id> (1,342)
PTN000000065

>  <COMPOUND_NUMBER> (1,342)
WAY-311386

>  <BAR_CODE_NO> (1,342)
3915765

>  <LOCATION_CODE> (1,342)
PTNCS

>  <AMOUNT_CURRENT> (1,342)
33.4

$$$$
WAY-310957
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,343)
1096

>  <Formula> (1,343)
C23H22N2O3

>  <MolWeight> (1,343)
374.43238

>  <PCAT_CMPD_ID> (1,343)
WAY-310957

>  <CNC_ID> (1,343)
359314699

>  <transfer_container_id> (1,343)
PTN000000065

>  <COMPOUND_NUMBER> (1,343)
WAY-310957

>  <BAR_CODE_NO> (1,343)
3915270

>  <LOCATION_CODE> (1,343)
PTNCS

>  <AMOUNT_CURRENT> (1,343)
33.4

$$$$
CL-404489
csChFnd80/10111816222D

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 10  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,344)
1097

>  <Formula> (1,344)
C16H15F3N2O4

>  <MolWeight> (1,344)
356.2965096

>  <PCAT_CMPD_ID> (1,344)
CL-404489

>  <CNC_ID> (1,344)
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>  <transfer_container_id> (1,344)
PTN000000067

>  <COMPOUND_NUMBER> (1,344)
CL-404489

>  <BAR_CODE_NO> (1,344)
3917353

>  <LOCATION_CODE> (1,344)
PTNCS

>  <AMOUNT_CURRENT> (1,344)
33.5

$$$$
WAY-312187
csChFnd80/10111816222D

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 10 13  1  0  0  0  0
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M  END
>  <Mol_ID> (1,345)
1098

>  <Formula> (1,345)
C16H13NO4

>  <MolWeight> (1,345)
283.27872

>  <PCAT_CMPD_ID> (1,345)
WAY-312187

>  <CNC_ID> (1,345)
359315927

>  <transfer_container_id> (1,345)
PTN000000065

>  <COMPOUND_NUMBER> (1,345)
WAY-312187

>  <BAR_CODE_NO> (1,345)
3916781

>  <LOCATION_CODE> (1,345)
PTNCS

>  <AMOUNT_CURRENT> (1,345)
33.5

$$$$
WAY-344299
csChFnd80/10111816222D

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 10  6  1  0  0  0  0
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 13 14  1  0  0  0  0
 14  9  2  0  0  0  0
 15  8  2  0  0  0  0
 16 13  2  0  0  0  0
 17  7  1  0  0  0  0
 18  7  2  0  0  0  0
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  3  5  1  0  0  0  0
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 12 16  1  0  0  0  0
 23 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,346)
1099

>  <Formula> (1,346)
C20H17N3S

>  <MolWeight> (1,346)
331.43408

>  <PCAT_CMPD_ID> (1,346)
WAY-344299

>  <CNC_ID> (1,346)
359319635

>  <transfer_container_id> (1,346)
PTN000000065

>  <COMPOUND_NUMBER> (1,346)
WAY-344299

>  <BAR_CODE_NO> (1,346)
2554462

>  <LOCATION_CODE> (1,346)
PTNCS

>  <AMOUNT_CURRENT> (1,346)
32.8

$$$$
CL-405421
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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 15 20  2  0  0  0  0
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 17 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
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 25 26  1  0  0  0  0
  9 11  1  0  0  0  0
 10 14  2  0  0  0  0
 13 18  1  0  0  0  0
 16 20  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,347)
1100

>  <Formula> (1,347)
C22H17BrN2O

>  <MolWeight> (1,347)
405.28718

>  <PCAT_CMPD_ID> (1,347)
CL-405421

>  <CNC_ID> (1,347)
359313592

>  <transfer_container_id> (1,347)
PTN000000065

>  <COMPOUND_NUMBER> (1,347)
CL-405421

>  <BAR_CODE_NO> (1,347)
3915280

>  <LOCATION_CODE> (1,347)
PTNCS

>  <AMOUNT_CURRENT> (1,347)
33.8

$$$$
WAY-344122
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 11 12  2  0  0  0  0
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 13 14  1  0  0  0  0
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 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
  1 20  1  0  0  0  0
 20 25  1  0  0  0  0
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M  END
>  <Mol_ID> (1,348)
1101

>  <Formula> (1,348)
C20H16N4S

>  <MolWeight> (1,348)
344.43284

>  <PCAT_CMPD_ID> (1,348)
WAY-344122

>  <CNC_ID> (1,348)
359319458

>  <transfer_container_id> (1,348)
PTN000000065

>  <COMPOUND_NUMBER> (1,348)
WAY-344122

>  <BAR_CODE_NO> (1,348)
2554379

>  <LOCATION_CODE> (1,348)
PTNCS

>  <AMOUNT_CURRENT> (1,348)
32.7

$$$$
WAY-313205
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  7 12  1  0  0  0  0
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 14 18  1  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,349)
1102

>  <Formula> (1,349)
C19H18N2OS

>  <MolWeight> (1,349)
322.42402

>  <PCAT_CMPD_ID> (1,349)
WAY-313205

>  <CNC_ID> (1,349)
359328241

>  <transfer_container_id> (1,349)
PTN000000067

>  <COMPOUND_NUMBER> (1,349)
WAY-313205

>  <BAR_CODE_NO> (1,349)
3918031

>  <LOCATION_CODE> (1,349)
PTNCS

>  <AMOUNT_CURRENT> (1,349)
33

$$$$
WAY-343791
csChFnd80/10111816222D

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 10  8  1  0  0  0  0
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 28 15  1  0  0  0  0
 13  9  1  0  0  0  0
M  END
>  <Mol_ID> (1,350)
1103

>  <Formula> (1,350)
C21H13ClF2N4OS

>  <MolWeight> (1,350)
442.8689264

>  <PCAT_CMPD_ID> (1,350)
WAY-343791

>  <CNC_ID> (1,350)
359319132

>  <transfer_container_id> (1,350)
PTN000000065

>  <COMPOUND_NUMBER> (1,350)
WAY-343791

>  <BAR_CODE_NO> (1,350)
2553908

>  <LOCATION_CODE> (1,350)
PTNCS

>  <AMOUNT_CURRENT> (1,350)
32.3

$$$$
WAY-342688
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    6.5667  -13.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  2  0  0  0  0
 13 17  1  0  0  0  0
 14  7  2  0  0  0  0
 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17 16  2  0  0  0  0
 18 10  1  0  0  0  0
 19 13  1  0  0  0  0
 20 11  1  0  0  0  0
 21 11  2  0  0  0  0
 22 15  2  0  0  0  0
 23 15  1  0  0  0  0
 24 18  1  0  0  0  0
 25 22  1  0  0  0  0
 26 23  2  0  0  0  0
 27 20  2  0  0  0  0
 28 21  1  0  0  0  0
 29 26  1  0  0  0  0
 30 28  2  0  0  0  0
  4  5  1  0  0  0  0
 25 29  2  0  0  0  0
 13 10  2  0  0  0  0
 27 30  1  0  0  0  0
M  END
>  <Mol_ID> (1,351)
1104

>  <Formula> (1,351)
C24H20N2O4

>  <MolWeight> (1,351)
400.4266

>  <PCAT_CMPD_ID> (1,351)
WAY-342688

>  <CNC_ID> (1,351)
359318942

>  <transfer_container_id> (1,351)
PTN000000065

>  <COMPOUND_NUMBER> (1,351)
WAY-342688

>  <BAR_CODE_NO> (1,351)
2555062

>  <LOCATION_CODE> (1,351)
PTNCS

>  <AMOUNT_CURRENT> (1,351)
32.5

$$$$
WAY-313199
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    3.6318    2.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  8  1  0  0  0  0
 11 10  2  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
 14 16  2  0  0  0  0
 15  8  2  0  0  0  0
 16 15  1  0  0  0  0
 17  9  1  0  0  0  0
 18  3  1  0  0  0  0
 19 17  1  0  0  0  0
 20 11  1  0  0  0  0
 21 14  1  0  0  0  0
 22 19  1  0  0  0  0
 23 24  1  0  0  0  0
 24 17  1  0  0  0  0
 25 23  1  0  0  0  0
 26 20  1  0  0  0  0
 27 22  1  0  0  0  0
  7  5  1  0  0  0  0
 14 11  1  0  0  0  0
 25 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,352)
1105

>  <Formula> (1,352)
C20H26N2O5

>  <MolWeight> (1,352)
374.43084

>  <PCAT_CMPD_ID> (1,352)
WAY-313199

>  <CNC_ID> (1,352)
359328235

>  <transfer_container_id> (1,352)
PTN000000067

>  <COMPOUND_NUMBER> (1,352)
WAY-313199

>  <BAR_CODE_NO> (1,352)
3918020

>  <LOCATION_CODE> (1,352)
PTNCS

>  <AMOUNT_CURRENT> (1,352)
33.4

$$$$
WAY-313191
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 12  8  1  0  0  0  0
 13  8  2  0  0  0  0
 14  4  1  0  0  0  0
 15  4  2  0  0  0  0
 16  5  2  0  0  0  0
 17 10  1  0  0  0  0
 18  9  1  0  0  0  0
 19 11  1  0  0  0  0
 20  3  1  0  0  0  0
 21 14  1  0  0  0  0
 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
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 25 24  1  0  0  0  0
 26 23  1  0  0  0  0
 27 25  1  0  0  0  0
  5  7  1  0  0  0  0
  9 10  1  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,353)
1106

>  <Formula> (1,353)
C19H23BrN2O5

>  <MolWeight> (1,353)
439.30032

>  <PCAT_CMPD_ID> (1,353)
WAY-313191

>  <CNC_ID> (1,353)
359328227

>  <transfer_container_id> (1,353)
PTN000000067

>  <COMPOUND_NUMBER> (1,353)
WAY-313191

>  <BAR_CODE_NO> (1,353)
3918005

>  <LOCATION_CODE> (1,353)
PTNCS

>  <AMOUNT_CURRENT> (1,353)
33.8

$$$$
WAY-310619
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -0.6805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 10  2  0  0  0  0
 10  8  1  0  0  0  0
 11 18  2  0  0  0  0
 12  9  1  0  0  0  0
 13 11  1  0  0  0  0
 14  4  2  0  0  0  0
 15 12  1  0  0  0  0
 16  8  2  0  0  0  0
 17  7  2  0  0  0  0
 18 16  1  0  0  0  0
 19  7  1  0  0  0  0
 20  3  1  0  0  0  0
 21 19  1  0  0  0  0
  4  6  1  0  0  0  0
 11  9  1  0  0  0  0
 15 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,354)
1107

>  <Formula> (1,354)
C14H14N2O5

>  <MolWeight> (1,354)
290.27136

>  <PCAT_CMPD_ID> (1,354)
WAY-310619

>  <CNC_ID> (1,354)
359314360

>  <transfer_container_id> (1,354)
PTN000000065

>  <COMPOUND_NUMBER> (1,354)
WAY-310619

>  <BAR_CODE_NO> (1,354)
3914857

>  <LOCATION_CODE> (1,354)
PTNCS

>  <AMOUNT_CURRENT> (1,354)
33.2

$$$$
CL-435229
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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   -0.0655    3.5793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  4 10  2  0  0  0  0
  5 11  2  0  0  0  0
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  6 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 13 17  2  0  0  0  0
 14 18  1  0  0  0  0
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 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
  7 13  1  0  0  0  0
 16 19  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,355)
1108

>  <Formula> (1,355)
C15H16N2O5

>  <MolWeight> (1,355)
304.29794

>  <PCAT_CMPD_ID> (1,355)
CL-435229

>  <CNC_ID> (1,355)
359326762

>  <transfer_container_id> (1,355)
PTN000000067

>  <COMPOUND_NUMBER> (1,355)
CL-435229

>  <BAR_CODE_NO> (1,355)
3917568

>  <LOCATION_CODE> (1,355)
PTNCS

>  <AMOUNT_CURRENT> (1,355)
33.4

$$$$
WAY-312819
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -6.9660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
  9  7  2  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  2  0  0  0  0
 13 12  1  0  0  0  0
 14  4  2  0  0  0  0
 15 12  1  0  0  0  0
 16 13  1  0  0  0  0
 17 15  1  0  0  0  0
 18  8  2  0  0  0  0
 19  9  1  0  0  0  0
 20  2  1  0  0  0  0
 21  5  1  0  0  0  0
 22  8  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
  5  4  1  0  0  0  0
 13 11  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,356)
1109

>  <Formula> (1,356)
C16H17BrN2O5

>  <MolWeight> (1,356)
397.22058

>  <PCAT_CMPD_ID> (1,356)
WAY-312819

>  <CNC_ID> (1,356)
359327856

>  <transfer_container_id> (1,356)
PTN000000067

>  <COMPOUND_NUMBER> (1,356)
WAY-312819

>  <BAR_CODE_NO> (1,356)
3917537

>  <LOCATION_CODE> (1,356)
PTNCS

>  <AMOUNT_CURRENT> (1,356)
33.1

$$$$
WAY-220865
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  4  1  0  0  0  0
  9  4  2  0  0  0  0
 10  5  2  0  0  0  0
 11  5  1  0  0  0  0
 12  2  1  0  0  0  0
 13  8  1  0  0  0  0
 14  3  1  0  0  0  0
 15 11  2  0  0  0  0
 16 10  1  0  0  0  0
 17 15  1  0  0  0  0
 18 13  1  0  0  0  0
 19 12  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  2  0  0  0  0
 22 18  1  0  0  0  0
 23 22  2  0  0  0  0
 24 21  1  0  0  0  0
 25 23  1  0  0  0  0
 14 19  1  0  0  0  0
 17 16  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,357)
1110

>  <Formula> (1,357)
C19H22N2O3S

>  <MolWeight> (1,357)
358.45458

>  <PCAT_CMPD_ID> (1,357)
WAY-220865

>  <CNC_ID> (1,357)
359313832

>  <transfer_container_id> (1,357)
PTN000000065

>  <COMPOUND_NUMBER> (1,357)
WAY-220865

>  <BAR_CODE_NO> (1,357)
3917079

>  <LOCATION_CODE> (1,357)
PTNCS

>  <AMOUNT_CURRENT> (1,357)
33.1

$$$$
WAY-310462
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
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  6 13  2  0  0  0  0
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  8 15  1  0  0  0  0
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 11 17  2  0  0  0  0
 12 18  1  0  0  0  0
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 13 20  1  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
  7 11  1  0  0  0  0
  9 13  1  0  0  0  0
 10 15  1  0  0  0  0
 18 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,358)
1111

>  <Formula> (1,358)
C19H21NO3

>  <MolWeight> (1,358)
311.37494

>  <PCAT_CMPD_ID> (1,358)
WAY-310462

>  <CNC_ID> (1,358)
359314203

>  <transfer_container_id> (1,358)
PTN000000065

>  <COMPOUND_NUMBER> (1,358)
WAY-310462

>  <BAR_CODE_NO> (1,358)
3914683

>  <LOCATION_CODE> (1,358)
PTNCS

>  <AMOUNT_CURRENT> (1,358)
33.6

$$$$
WAY-311702
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11 13  2  0  0  0  0
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 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,359)
1112

>  <Formula> (1,359)
C15H12FNO3

>  <MolWeight> (1,359)
273.2590832

>  <PCAT_CMPD_ID> (1,359)
WAY-311702

>  <CNC_ID> (1,359)
359315443

>  <transfer_container_id> (1,359)
PTN000000065

>  <COMPOUND_NUMBER> (1,359)
WAY-311702

>  <BAR_CODE_NO> (1,359)
3916173

>  <LOCATION_CODE> (1,359)
PTNCS

>  <AMOUNT_CURRENT> (1,359)
33.9

$$$$
WAY-313073
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 21 24  2  0  0  0  0
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 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,360)
1113

>  <Formula> (1,360)
C18H15FN2O3

>  <MolWeight> (1,360)
326.3217032

>  <PCAT_CMPD_ID> (1,360)
WAY-313073

>  <CNC_ID> (1,360)
359328109

>  <transfer_container_id> (1,360)
PTN000000067

>  <COMPOUND_NUMBER> (1,360)
WAY-313073

>  <BAR_CODE_NO> (1,360)
3917858

>  <LOCATION_CODE> (1,360)
PTNCS

>  <AMOUNT_CURRENT> (1,360)
33.3

$$$$
WAY-313042
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
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 20 22  2  0  0  0  0
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 22 24  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,361)
1114

>  <Formula> (1,361)
C19H18N2O3

>  <MolWeight> (1,361)
322.35782

>  <PCAT_CMPD_ID> (1,361)
WAY-313042

>  <CNC_ID> (1,361)
359328079

>  <transfer_container_id> (1,361)
PTN000000067

>  <COMPOUND_NUMBER> (1,361)
WAY-313042

>  <BAR_CODE_NO> (1,361)
3917820

>  <LOCATION_CODE> (1,361)
PTNCS

>  <AMOUNT_CURRENT> (1,361)
33.1

$$$$
WAY-313255
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,362)
1115

>  <Formula> (1,362)
C19H19N3O3

>  <MolWeight> (1,362)
337.37246

>  <PCAT_CMPD_ID> (1,362)
WAY-313255

>  <CNC_ID> (1,362)
359328291

>  <transfer_container_id> (1,362)
PTN000000067

>  <COMPOUND_NUMBER> (1,362)
WAY-313255

>  <BAR_CODE_NO> (1,362)
3918102

>  <LOCATION_CODE> (1,362)
PTNCS

>  <AMOUNT_CURRENT> (1,362)
33.7

$$$$
WAY-312332
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 17 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,363)
1116

>  <Formula> (1,363)
C20H22N2O5S

>  <MolWeight> (1,363)
402.46408

>  <PCAT_CMPD_ID> (1,363)
WAY-312332

>  <CNC_ID> (1,363)
359316072

>  <transfer_container_id> (1,363)
PTN000000065

>  <COMPOUND_NUMBER> (1,363)
WAY-312332

>  <BAR_CODE_NO> (1,363)
3916952

>  <LOCATION_CODE> (1,363)
PTNCS

>  <AMOUNT_CURRENT> (1,363)
33.8

$$$$
CL-408172
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,364)
1117

>  <Formula> (1,364)
C16H19NO4

>  <MolWeight> (1,364)
289.32636

>  <PCAT_CMPD_ID> (1,364)
CL-408172

>  <CNC_ID> (1,364)
359313600

>  <transfer_container_id> (1,364)
PTN000000065

>  <COMPOUND_NUMBER> (1,364)
CL-408172

>  <BAR_CODE_NO> (1,364)
3914738

>  <LOCATION_CODE> (1,364)
PTNCS

>  <AMOUNT_CURRENT> (1,364)
33.3

$$$$
WAY-313167
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,365)
1118

>  <Formula> (1,365)
C24H17N3O2

>  <MolWeight> (1,365)
379.41068

>  <PCAT_CMPD_ID> (1,365)
WAY-313167

>  <CNC_ID> (1,365)
359328203

>  <transfer_container_id> (1,365)
PTN000000067

>  <COMPOUND_NUMBER> (1,365)
WAY-313167

>  <BAR_CODE_NO> (1,365)
3917972

>  <LOCATION_CODE> (1,365)
PTNCS

>  <AMOUNT_CURRENT> (1,365)
33.8

$$$$
WAY-313343
csChFnd80/10111816222D

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 10  9  2  0  0  0  0
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 14  4  1  0  0  0  0
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 18  9  1  0  0  0  0
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M  END
>  <Mol_ID> (1,366)
1119

>  <Formula> (1,366)
C19H17N3O3

>  <MolWeight> (1,366)
335.35658

>  <PCAT_CMPD_ID> (1,366)
WAY-313343

>  <CNC_ID> (1,366)
359328379

>  <transfer_container_id> (1,366)
PTN000000067

>  <COMPOUND_NUMBER> (1,366)
WAY-313343

>  <BAR_CODE_NO> (1,366)
3918220

>  <LOCATION_CODE> (1,366)
PTNCS

>  <AMOUNT_CURRENT> (1,366)
33.8

$$$$
WAY-344071
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 16  8  1  0  0  0  0
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 10  8  2  0  0  0  0
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M  END
>  <Mol_ID> (1,367)
1120

>  <Formula> (1,367)
C16H17N5OS

>  <MolWeight> (1,367)
327.40408

>  <PCAT_CMPD_ID> (1,367)
WAY-344071

>  <CNC_ID> (1,367)
359319407

>  <transfer_container_id> (1,367)
PTN000000065

>  <COMPOUND_NUMBER> (1,367)
WAY-344071

>  <BAR_CODE_NO> (1,367)
2554233

>  <LOCATION_CODE> (1,367)
PTNCS

>  <AMOUNT_CURRENT> (1,367)
32.6

$$$$
WAY-313109
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,368)
1121

>  <Formula> (1,368)
C21H23N3O3

>  <MolWeight> (1,368)
365.42562

>  <PCAT_CMPD_ID> (1,368)
WAY-313109

>  <CNC_ID> (1,368)
359328145

>  <transfer_container_id> (1,368)
PTN000000067

>  <COMPOUND_NUMBER> (1,368)
WAY-313109

>  <BAR_CODE_NO> (1,368)
3917906

>  <LOCATION_CODE> (1,368)
PTNCS

>  <AMOUNT_CURRENT> (1,368)
33.2

$$$$
WAY-312683
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,369)
1122

>  <Formula> (1,369)
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>  <MolWeight> (1,369)
351.39904

>  <PCAT_CMPD_ID> (1,369)
WAY-312683

>  <CNC_ID> (1,369)
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>  <transfer_container_id> (1,369)
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>  <COMPOUND_NUMBER> (1,369)
WAY-312683

>  <BAR_CODE_NO> (1,369)
3917346

>  <LOCATION_CODE> (1,369)
PTNCS

>  <AMOUNT_CURRENT> (1,369)
33.2

$$$$
WAY-312907
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,370)
1123

>  <Formula> (1,370)
C13H17N3O2S2

>  <MolWeight> (1,370)
311.42298

>  <PCAT_CMPD_ID> (1,370)
WAY-312907

>  <CNC_ID> (1,370)
359327944

>  <transfer_container_id> (1,370)
PTN000000067

>  <COMPOUND_NUMBER> (1,370)
WAY-312907

>  <BAR_CODE_NO> (1,370)
3917639

>  <LOCATION_CODE> (1,370)
PTNCS

>  <AMOUNT_CURRENT> (1,370)
33.8

$$$$
WAY-311271
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,371)
1124

>  <Formula> (1,371)
C20H19N5O4

>  <MolWeight> (1,371)
393.39596

>  <PCAT_CMPD_ID> (1,371)
WAY-311271

>  <CNC_ID> (1,371)
359315012

>  <transfer_container_id> (1,371)
PTN000000065

>  <COMPOUND_NUMBER> (1,371)
WAY-311271

>  <BAR_CODE_NO> (1,371)
3915641

>  <LOCATION_CODE> (1,371)
PTNCS

>  <AMOUNT_CURRENT> (1,371)
33.6

$$$$
CL-423090
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,372)
1125

>  <Formula> (1,372)
C16H15NO5

>  <MolWeight> (1,372)
301.294

>  <PCAT_CMPD_ID> (1,372)
CL-423090

>  <CNC_ID> (1,372)
359313625

>  <transfer_container_id> (1,372)
PTN000000065

>  <COMPOUND_NUMBER> (1,372)
CL-423090

>  <BAR_CODE_NO> (1,372)
3915962

>  <LOCATION_CODE> (1,372)
PTNCS

>  <AMOUNT_CURRENT> (1,372)
33.1

$$$$
WAY-344131
csChFnd80/10111816222D

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 10  9  1  0  0  0  0
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M  END
>  <Mol_ID> (1,373)
1126

>  <Formula> (1,373)
C23H24N4OS

>  <MolWeight> (1,373)
404.52786

>  <PCAT_CMPD_ID> (1,373)
WAY-344131

>  <CNC_ID> (1,373)
359319467

>  <transfer_container_id> (1,373)
PTN000000065

>  <COMPOUND_NUMBER> (1,373)
WAY-344131

>  <BAR_CODE_NO> (1,373)
2554388

>  <LOCATION_CODE> (1,373)
PTNCS

>  <AMOUNT_CURRENT> (1,373)
32.1

$$$$
CL-416074
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,374)
1127

>  <Formula> (1,374)
C13H21NO4

>  <MolWeight> (1,374)
255.31014

>  <PCAT_CMPD_ID> (1,374)
CL-416074

>  <CNC_ID> (1,374)
359313612

>  <transfer_container_id> (1,374)
PTN000000065

>  <COMPOUND_NUMBER> (1,374)
CL-416074

>  <BAR_CODE_NO> (1,374)
3916709

>  <LOCATION_CODE> (1,374)
PTNCS

>  <AMOUNT_CURRENT> (1,374)
33.6

$$$$
WAY-310540
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  6  2  0  0  0  0
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  4 10  2  0  0  0  0
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 11 16  1  0  0  0  0
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 12 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
  7  9  1  0  0  0  0
 13 16  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,375)
1128

>  <Formula> (1,375)
C18H20N2O5

>  <MolWeight> (1,375)
344.3618

>  <PCAT_CMPD_ID> (1,375)
WAY-310540

>  <CNC_ID> (1,375)
359314281

>  <transfer_container_id> (1,375)
PTN000000065

>  <COMPOUND_NUMBER> (1,375)
WAY-310540

>  <BAR_CODE_NO> (1,375)
3914771

>  <LOCATION_CODE> (1,375)
PTNCS

>  <AMOUNT_CURRENT> (1,375)
33.4

$$$$
CL-417870
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 19  2  0  0  0  0
 12 20  1  0  0  0  0
 15 21  1  0  0  0  0
 18 22  2  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
 21 25  2  0  0  0  0
 22 26  1  0  0  0  0
  7 11  1  0  0  0  0
 13 20  1  0  0  0  0
 16 21  1  0  0  0  0
 19 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,376)
1129

>  <Formula> (1,376)
C19H19N3O4

>  <MolWeight> (1,376)
353.37186

>  <PCAT_CMPD_ID> (1,376)
CL-417870

>  <CNC_ID> (1,376)
359313618

>  <transfer_container_id> (1,376)
PTN000000065

>  <COMPOUND_NUMBER> (1,376)
CL-417870

>  <BAR_CODE_NO> (1,376)
3916301

>  <LOCATION_CODE> (1,376)
PTNCS

>  <AMOUNT_CURRENT> (1,376)
33.5

$$$$
WAY-310791
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 14 16  1  0  0  0  0
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 24 26  2  0  0  0  0
  5  7  1  0  0  0  0
 20 22  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,377)
1130

>  <Formula> (1,377)
C18H19N3O4S

>  <MolWeight> (1,377)
373.42616

>  <PCAT_CMPD_ID> (1,377)
WAY-310791

>  <CNC_ID> (1,377)
359314532

>  <transfer_container_id> (1,377)
PTN000000065

>  <COMPOUND_NUMBER> (1,377)
WAY-310791

>  <BAR_CODE_NO> (1,377)
3915065

>  <LOCATION_CODE> (1,377)
PTNCS

>  <AMOUNT_CURRENT> (1,377)
33.3

$$$$
WAY-217159
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 13  2  0  0  0  0
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 17 19  2  0  0  0  0
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  8  9  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (1,378)
1131

>  <Formula> (1,378)
C15H18N2O2

>  <MolWeight> (1,378)
258.31562

>  <PCAT_CMPD_ID> (1,378)
WAY-217159

>  <CNC_ID> (1,378)
359313800

>  <transfer_container_id> (1,378)
PTN000000065

>  <COMPOUND_NUMBER> (1,378)
WAY-217159

>  <BAR_CODE_NO> (1,378)
3914972

>  <LOCATION_CODE> (1,378)
PTNCS

>  <AMOUNT_CURRENT> (1,378)
33.8

$$$$
WAY-311527
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
   -0.8103    0.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  7 10  1  0  0  0  0
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M  END
>  <Mol_ID> (1,379)
1132

>  <Formula> (1,379)
C14H18N2O2

>  <MolWeight> (1,379)
246.30492

>  <PCAT_CMPD_ID> (1,379)
WAY-311527

>  <CNC_ID> (1,379)
359315268

>  <transfer_container_id> (1,379)
PTN000000065

>  <COMPOUND_NUMBER> (1,379)
WAY-311527

>  <BAR_CODE_NO> (1,379)
3915924

>  <LOCATION_CODE> (1,379)
PTNCS

>  <AMOUNT_CURRENT> (1,379)
33.3

$$$$
WAY-311311
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,380)
1133

>  <Formula> (1,380)
C14H17NO2

>  <MolWeight> (1,380)
231.29028

>  <PCAT_CMPD_ID> (1,380)
WAY-311311

>  <CNC_ID> (1,380)
359315052

>  <transfer_container_id> (1,380)
PTN000000065

>  <COMPOUND_NUMBER> (1,380)
WAY-311311

>  <BAR_CODE_NO> (1,380)
3915683

>  <LOCATION_CODE> (1,380)
PTNCS

>  <AMOUNT_CURRENT> (1,380)
33.5

$$$$
WAY-313105
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  2  0  0  0  0
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 18  8  1  0  0  0  0
 19  7  1  0  0  0  0
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 20 21  1  0  0  0  0
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M  END
>  <Mol_ID> (1,381)
1134

>  <Formula> (1,381)
C16H11ClN2O2

>  <MolWeight> (1,381)
298.72374

>  <PCAT_CMPD_ID> (1,381)
WAY-313105

>  <CNC_ID> (1,381)
359328141

>  <transfer_container_id> (1,381)
PTN000000067

>  <COMPOUND_NUMBER> (1,381)
WAY-313105

>  <BAR_CODE_NO> (1,381)
3917900

>  <LOCATION_CODE> (1,381)
PTNCS

>  <AMOUNT_CURRENT> (1,381)
33.1

$$$$
WAY-344411
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
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 11  1  1  0  0  0  0
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 14  6  1  0  0  0  0
 15  5  2  0  0  0  0
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 17  6  2  0  0  0  0
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 21  9  1  0  0  0  0
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 26  4  2  0  0  0  0
 27  8  2  0  0  0  0
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 29 21  1  0  0  0  0
 30 26  1  0  0  0  0
 31 30  2  0  0  0  0
  3  8  1  0  0  0  0
 31 27  1  0  0  0  0
 24 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,382)
1135

>  <Formula> (1,382)
C22H22FN3O5

>  <MolWeight> (1,382)
427.4255832

>  <PCAT_CMPD_ID> (1,382)
WAY-344411

>  <CNC_ID> (1,382)
359319746

>  <transfer_container_id> (1,382)
PTN000000065

>  <COMPOUND_NUMBER> (1,382)
WAY-344411

>  <BAR_CODE_NO> (1,382)
2554596

>  <LOCATION_CODE> (1,382)
PTNCS

>  <AMOUNT_CURRENT> (1,382)
32.7

$$$$
WAY-342678
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 13  6  1  0  0  0  0
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 15  5  2  0  0  0  0
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 16 12  2  0  0  0  0
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M  END
>  <Mol_ID> (1,383)
1136

>  <Formula> (1,383)
C19H13Cl2FN4O2

>  <MolWeight> (1,383)
419.2365232

>  <PCAT_CMPD_ID> (1,383)
WAY-342678

>  <CNC_ID> (1,383)
359318933

>  <transfer_container_id> (1,383)
PTN000000065

>  <COMPOUND_NUMBER> (1,383)
WAY-342678

>  <BAR_CODE_NO> (1,383)
2554676

>  <LOCATION_CODE> (1,383)
PTNCS

>  <AMOUNT_CURRENT> (1,383)
32.8

$$$$
WAY-333728
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,384)
1137

>  <Formula> (1,384)
C21H17N5O4

>  <MolWeight> (1,384)
403.39078

>  <PCAT_CMPD_ID> (1,384)
WAY-333728

>  <CNC_ID> (1,384)
359332261

>  <transfer_container_id> (1,384)
PTN000000073

>  <COMPOUND_NUMBER> (1,384)
WAY-333728

>  <BAR_CODE_NO> (1,384)
2547856

>  <LOCATION_CODE> (1,384)
PTNCS

>  <AMOUNT_CURRENT> (1,384)
32.2

$$$$
WAY-312258
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,385)
1138

>  <Formula> (1,385)
C11H12N4O3

>  <MolWeight> (1,385)
248.23798

>  <PCAT_CMPD_ID> (1,385)
WAY-312258

>  <CNC_ID> (1,385)
359315998

>  <transfer_container_id> (1,385)
PTN000000065

>  <COMPOUND_NUMBER> (1,385)
WAY-312258

>  <BAR_CODE_NO> (1,385)
3916860

>  <LOCATION_CODE> (1,385)
PTNCS

>  <AMOUNT_CURRENT> (1,385)
33

$$$$
WAY-310808
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 14  1  0  0  0  0
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 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 10 13  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,386)
1139

>  <Formula> (1,386)
C16H18N2O3S

>  <MolWeight> (1,386)
318.39072

>  <PCAT_CMPD_ID> (1,386)
WAY-310808

>  <CNC_ID> (1,386)
359314549

>  <transfer_container_id> (1,386)
PTN000000065

>  <COMPOUND_NUMBER> (1,386)
WAY-310808

>  <BAR_CODE_NO> (1,386)
3915086

>  <LOCATION_CODE> (1,386)
PTNCS

>  <AMOUNT_CURRENT> (1,386)
33.9

$$$$
WAY-345486
csChFnd80/10111816222D

 24 25  0  0  1  0  0  0  0  0999 V2000
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 18 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,387)
1140

>  <Formula> (1,387)
C16H17ClN2O4S

>  <MolWeight> (1,387)
368.83518

>  <PCAT_CMPD_ID> (1,387)
WAY-345486

>  <CNC_ID> (1,387)
359320755

>  <transfer_container_id> (1,387)
PTN000000065

>  <COMPOUND_NUMBER> (1,387)
WAY-345486

>  <BAR_CODE_NO> (1,387)
2555851

>  <LOCATION_CODE> (1,387)
PTNCS

>  <AMOUNT_CURRENT> (1,387)
32.9

$$$$
WAY-217122
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12 15  2  0  0  0  0
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M  END
>  <Mol_ID> (1,388)
1141

>  <Formula> (1,388)
C18H19N3O4S

>  <MolWeight> (1,388)
373.42616

>  <PCAT_CMPD_ID> (1,388)
WAY-217122

>  <CNC_ID> (1,388)
359326850

>  <transfer_container_id> (1,388)
PTN000000067

>  <COMPOUND_NUMBER> (1,388)
WAY-217122

>  <BAR_CODE_NO> (1,388)
3917650

>  <LOCATION_CODE> (1,388)
PTNCS

>  <AMOUNT_CURRENT> (1,388)
33.7

$$$$
WAY-231705-A
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  7  1  0  0  0  0
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 13  8  1  0  0  0  0
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 16  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,389)
1142

>  <Formula> (1,389)
C13H19N3O

>  <MolWeight> (1,389)
233.30946

>  <PCAT_CMPD_ID> (1,389)
WAY-231705-A

>  <CNC_ID> (1,389)
359313902

>  <transfer_container_id> (1,389)
PTN000000065

>  <COMPOUND_NUMBER> (1,389)
WAY-231705-A

>  <BAR_CODE_NO> (1,389)
3916075

>  <LOCATION_CODE> (1,389)
PTNCS

>  <AMOUNT_CURRENT> (1,389)
33.2

$$$$
WAY-237667-A
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
   13.4480   -7.3230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (1,390)
1143

>  <Formula> (1,390)
C14H19N3O2

>  <MolWeight> (1,390)
261.31956

>  <PCAT_CMPD_ID> (1,390)
WAY-237667-A

>  <CNC_ID> (1,390)
359326908

>  <transfer_container_id> (1,390)
PTN000000067

>  <COMPOUND_NUMBER> (1,390)
WAY-237667-A

>  <BAR_CODE_NO> (1,390)
3917990

>  <LOCATION_CODE> (1,390)
PTNCS

>  <AMOUNT_CURRENT> (1,390)
33.1

$$$$
CL-832417
csChFnd80/10111816222D

 15 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,391)
1144

>  <Formula> (1,391)
C10H12Cl2O3

>  <MolWeight> (1,391)
251.10648

>  <PCAT_CMPD_ID> (1,391)
CL-832417

>  <CNC_ID> (1,391)
359313642

>  <transfer_container_id> (1,391)
PTN000000065

>  <COMPOUND_NUMBER> (1,391)
CL-832417

>  <BAR_CODE_NO> (1,391)
3917170

>  <LOCATION_CODE> (1,391)
PTNCS

>  <AMOUNT_CURRENT> (1,391)
33.8

$$$$
WAY-310696
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,392)
1145

>  <Formula> (1,392)
C13H11FO3

>  <MolWeight> (1,392)
234.2230432

>  <PCAT_CMPD_ID> (1,392)
WAY-310696

>  <CNC_ID> (1,392)
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>  <transfer_container_id> (1,392)
PTN000000065

>  <COMPOUND_NUMBER> (1,392)
WAY-310696

>  <BAR_CODE_NO> (1,392)
3914945

>  <LOCATION_CODE> (1,392)
PTNCS

>  <AMOUNT_CURRENT> (1,392)
33.6

$$$$
WAY-313364
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,393)
1146

>  <Formula> (1,393)
C14H14O3

>  <MolWeight> (1,393)
230.25916

>  <PCAT_CMPD_ID> (1,393)
WAY-313364

>  <CNC_ID> (1,393)
359328400

>  <transfer_container_id> (1,393)
PTN000000067

>  <COMPOUND_NUMBER> (1,393)
WAY-313364

>  <BAR_CODE_NO> (1,393)
3918248

>  <LOCATION_CODE> (1,393)
PTNCS

>  <AMOUNT_CURRENT> (1,393)
33.4

$$$$
WAY-230423
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,394)
1147

>  <Formula> (1,394)
C17H20O6

>  <MolWeight> (1,394)
320.3371

>  <PCAT_CMPD_ID> (1,394)
WAY-230423

>  <CNC_ID> (1,394)
359326880

>  <transfer_container_id> (1,394)
PTN000000067

>  <COMPOUND_NUMBER> (1,394)
WAY-230423

>  <BAR_CODE_NO> (1,394)
3918206

>  <LOCATION_CODE> (1,394)
PTNCS

>  <AMOUNT_CURRENT> (1,394)
33.2

$$$$
WAY-310318
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,395)
1148

>  <Formula> (1,395)
C13H10N2OS

>  <MolWeight> (1,395)
242.2963

>  <PCAT_CMPD_ID> (1,395)
WAY-310318

>  <CNC_ID> (1,395)
359314059

>  <transfer_container_id> (1,395)
PTN000000065

>  <COMPOUND_NUMBER> (1,395)
WAY-310318

>  <BAR_CODE_NO> (1,395)
3914522

>  <LOCATION_CODE> (1,395)
PTNCS

>  <AMOUNT_CURRENT> (1,395)
33.3

$$$$
WAY-344770
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,396)
1149

>  <Formula> (1,396)
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>  <MolWeight> (1,396)
433.50126

>  <PCAT_CMPD_ID> (1,396)
WAY-344770

>  <CNC_ID> (1,396)
359320081

>  <transfer_container_id> (1,396)
PTN000000065

>  <COMPOUND_NUMBER> (1,396)
WAY-344770

>  <BAR_CODE_NO> (1,396)
2555010

>  <LOCATION_CODE> (1,396)
PTNCS

>  <AMOUNT_CURRENT> (1,396)
28.9

$$$$
CL-148617
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,397)
1150

>  <Formula> (1,397)
C21H23N5O3S

>  <MolWeight> (1,397)
425.50402

>  <PCAT_CMPD_ID> (1,397)
CL-148617

>  <CNC_ID> (1,397)
359313560

>  <transfer_container_id> (1,397)
PTN000000065

>  <COMPOUND_NUMBER> (1,397)
CL-148617

>  <BAR_CODE_NO> (1,397)
2555351

>  <LOCATION_CODE> (1,397)
PTNCS

>  <AMOUNT_CURRENT> (1,397)
32.7

$$$$
WAY-343585
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,398)
1151

>  <Formula> (1,398)
C12H14N4

>  <MolWeight> (1,398)
214.26636

>  <PCAT_CMPD_ID> (1,398)
WAY-343585

>  <CNC_ID> (1,398)
359318995

>  <transfer_container_id> (1,398)
PTN000000065

>  <COMPOUND_NUMBER> (1,398)
WAY-343585

>  <BAR_CODE_NO> (1,398)
2554179

>  <LOCATION_CODE> (1,398)
PTNCS

>  <AMOUNT_CURRENT> (1,398)
30.5

$$$$
WAY-312241
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,399)
1152

>  <Formula> (1,399)
C12H6Cl2N2OS2

>  <MolWeight> (1,399)
329.22484

>  <PCAT_CMPD_ID> (1,399)
WAY-312241

>  <CNC_ID> (1,399)
359315981

>  <transfer_container_id> (1,399)
PTN000000065

>  <COMPOUND_NUMBER> (1,399)
WAY-312241

>  <BAR_CODE_NO> (1,399)
3916841

>  <LOCATION_CODE> (1,399)
PTNCS

>  <AMOUNT_CURRENT> (1,399)
33.8

$$$$
WAY-119067
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,400)
1153

>  <Formula> (1,400)
C13H10N2O2S2

>  <MolWeight> (1,400)
290.3607

>  <PCAT_CMPD_ID> (1,400)
WAY-119067

>  <CNC_ID> (1,400)
359326837

>  <transfer_container_id> (1,400)
PTN000000067

>  <COMPOUND_NUMBER> (1,400)
WAY-119067

>  <BAR_CODE_NO> (1,400)
3917891

>  <LOCATION_CODE> (1,400)
PTNCS

>  <AMOUNT_CURRENT> (1,400)
33.4

$$$$
WAY-310423
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 12  2  0  0  0  0
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  9 11  1  0  0  0  0
 15 16  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,401)
1154

>  <Formula> (1,401)
C13H9ClN2O2S2

>  <MolWeight> (1,401)
324.80576

>  <PCAT_CMPD_ID> (1,401)
WAY-310423

>  <CNC_ID> (1,401)
359314164

>  <transfer_container_id> (1,401)
PTN000000065

>  <COMPOUND_NUMBER> (1,401)
WAY-310423

>  <BAR_CODE_NO> (1,401)
3914637

>  <LOCATION_CODE> (1,401)
PTNCS

>  <AMOUNT_CURRENT> (1,401)
33.7

$$$$
WAY-343819
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 13 16  2  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 21 22  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,402)
1155

>  <Formula> (1,402)
C14H9BrClN3O2S

>  <MolWeight> (1,402)
398.66216

>  <PCAT_CMPD_ID> (1,402)
WAY-343819

>  <CNC_ID> (1,402)
359319160

>  <transfer_container_id> (1,402)
PTN000000065

>  <COMPOUND_NUMBER> (1,402)
WAY-343819

>  <BAR_CODE_NO> (1,402)
2554327

>  <LOCATION_CODE> (1,402)
PTNCS

>  <AMOUNT_CURRENT> (1,402)
33

$$$$
WAY-344534
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  9  1  2  0  0  0  0
 10  3  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  2  0  0  0  0
 13 11  1  0  0  0  0
 14  9  1  0  0  0  0
 15  6  2  0  0  0  0
 16  5  1  0  0  0  0
 17 19  1  0  0  0  0
 18  4  1  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 14 10  2  0  0  0  0
 17  7  2  0  0  0  0
M  END
>  <Mol_ID> (1,403)
1156

>  <Formula> (1,403)
C14H11Cl2NO3

>  <MolWeight> (1,403)
312.14804

>  <PCAT_CMPD_ID> (1,403)
WAY-344534

>  <CNC_ID> (1,403)
359319857

>  <transfer_container_id> (1,403)
PTN000000065

>  <COMPOUND_NUMBER> (1,403)
WAY-344534

>  <BAR_CODE_NO> (1,403)
2554757

>  <LOCATION_CODE> (1,403)
PTNCS

>  <AMOUNT_CURRENT> (1,403)
32.2

$$$$
WAY-344235
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 18  1  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  9  2  0  0  0  0
 15 11  2  0  0  0  0
 16 10  1  0  0  0  0
 17 11  1  0  0  0  0
 18  8  1  0  0  0  0
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 20  4  2  0  0  0  0
 21  6  2  0  0  0  0
 22 10  2  0  0  0  0
 23 16  1  0  0  0  0
 24 16  2  0  0  0  0
 25 20  1  0  0  0  0
 26 21  1  0  0  0  0
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 28 27  2  0  0  0  0
  4  6  1  0  0  0  0
 25 26  2  0  0  0  0
 24 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,404)
1157

>  <Formula> (1,404)
C20H17ClN2O4S

>  <MolWeight> (1,404)
416.87798

>  <PCAT_CMPD_ID> (1,404)
WAY-344235

>  <CNC_ID> (1,404)
359319573

>  <transfer_container_id> (1,404)
PTN000000065

>  <COMPOUND_NUMBER> (1,404)
WAY-344235

>  <BAR_CODE_NO> (1,404)
2554582

>  <LOCATION_CODE> (1,404)
PTNCS

>  <AMOUNT_CURRENT> (1,404)
32.5

$$$$
WAY-344200
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 18 20  1  0  0  0  0
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 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
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  8 10  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,405)
1158

>  <Formula> (1,405)
C16H13ClN4O3S

>  <MolWeight> (1,405)
376.81742

>  <PCAT_CMPD_ID> (1,405)
WAY-344200

>  <CNC_ID> (1,405)
359319535

>  <transfer_container_id> (1,405)
PTN000000065

>  <COMPOUND_NUMBER> (1,405)
WAY-344200

>  <BAR_CODE_NO> (1,405)
2554486

>  <LOCATION_CODE> (1,405)
PTNCS

>  <AMOUNT_CURRENT> (1,405)
32.1

$$$$
WAY-119063
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,406)
1159

>  <Formula> (1,406)
C14H22N2O3S

>  <MolWeight> (1,406)
298.40108

>  <PCAT_CMPD_ID> (1,406)
WAY-119063

>  <CNC_ID> (1,406)
359326836

>  <transfer_container_id> (1,406)
PTN000000067

>  <COMPOUND_NUMBER> (1,406)
WAY-119063

>  <BAR_CODE_NO> (1,406)
3917395

>  <LOCATION_CODE> (1,406)
PTNCS

>  <AMOUNT_CURRENT> (1,406)
33.8

$$$$
WAY-312670
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 16 19  1  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,407)
1160

>  <Formula> (1,407)
C16H23BrN2

>  <MolWeight> (1,407)
323.27122

>  <PCAT_CMPD_ID> (1,407)
WAY-312670

>  <CNC_ID> (1,407)
359327707

>  <transfer_container_id> (1,407)
PTN000000067

>  <COMPOUND_NUMBER> (1,407)
WAY-312670

>  <BAR_CODE_NO> (1,407)
3917331

>  <LOCATION_CODE> (1,407)
PTNCS

>  <AMOUNT_CURRENT> (1,407)
33.7

$$$$
WAY-345532
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  2  2  0  0  0  0
 12  5  2  0  0  0  0
 13  4  2  0  0  0  0
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 15  7  1  0  0  0  0
 16  4  1  0  0  0  0
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 18 15  2  0  0  0  0
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 13 18  1  0  0  0  0
  9  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,408)
1161

>  <Formula> (1,408)
C13H14ClNO3S

>  <MolWeight> (1,408)
299.77316

>  <PCAT_CMPD_ID> (1,408)
WAY-345532

>  <CNC_ID> (1,408)
359320794

>  <transfer_container_id> (1,408)
PTN000000065

>  <COMPOUND_NUMBER> (1,408)
WAY-345532

>  <BAR_CODE_NO> (1,408)
2555783

>  <LOCATION_CODE> (1,408)
PTNCS

>  <AMOUNT_CURRENT> (1,408)
32.5

$$$$
WAY-311916
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    0.1000   -2.4793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 18  1  0  0  0  0
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 10 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,409)
1162

>  <Formula> (1,409)
C14H23NO3

>  <MolWeight> (1,409)
253.33732

>  <PCAT_CMPD_ID> (1,409)
WAY-311916

>  <CNC_ID> (1,409)
359315657

>  <transfer_container_id> (1,409)
PTN000000065

>  <COMPOUND_NUMBER> (1,409)
WAY-311916

>  <BAR_CODE_NO> (1,409)
3916444

>  <LOCATION_CODE> (1,409)
PTNCS

>  <AMOUNT_CURRENT> (1,409)
33.5

$$$$
WAY-311920
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,410)
1163

>  <Formula> (1,410)
C14H23NO3

>  <MolWeight> (1,410)
253.33732

>  <PCAT_CMPD_ID> (1,410)
WAY-311920

>  <CNC_ID> (1,410)
359315661

>  <transfer_container_id> (1,410)
PTN000000065

>  <COMPOUND_NUMBER> (1,410)
WAY-311920

>  <BAR_CODE_NO> (1,410)
3916456

>  <LOCATION_CODE> (1,410)
PTNCS

>  <AMOUNT_CURRENT> (1,410)
33.1

$$$$
WAY-219019
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,411)
1164

>  <Formula> (1,411)
C14H23NO3

>  <MolWeight> (1,411)
253.33732

>  <PCAT_CMPD_ID> (1,411)
WAY-219019

>  <CNC_ID> (1,411)
359313829

>  <transfer_container_id> (1,411)
PTN000000065

>  <COMPOUND_NUMBER> (1,411)
WAY-219019

>  <BAR_CODE_NO> (1,411)
3916453

>  <LOCATION_CODE> (1,411)
PTNCS

>  <AMOUNT_CURRENT> (1,411)
33.6

$$$$
WAY-310820
csChFnd80/10111816222D

 15 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,412)
1165

>  <Formula> (1,412)
C9H12N2O3S

>  <MolWeight> (1,412)
228.26818

>  <PCAT_CMPD_ID> (1,412)
WAY-310820

>  <CNC_ID> (1,412)
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>  <transfer_container_id> (1,412)
PTN000000065

>  <COMPOUND_NUMBER> (1,412)
WAY-310820

>  <BAR_CODE_NO> (1,412)
3915100

>  <LOCATION_CODE> (1,412)
PTNCS

>  <AMOUNT_CURRENT> (1,412)
33.2

$$$$
WAY-310879
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,413)
1166

>  <Formula> (1,413)
C19H23N3O5S2

>  <MolWeight> (1,413)
437.53302

>  <PCAT_CMPD_ID> (1,413)
WAY-310879

>  <CNC_ID> (1,413)
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>  <transfer_container_id> (1,413)
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>  <COMPOUND_NUMBER> (1,413)
WAY-310879

>  <BAR_CODE_NO> (1,413)
3915173

>  <LOCATION_CODE> (1,413)
PTNCS

>  <AMOUNT_CURRENT> (1,413)
33.1

$$$$
CL-415033
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,414)
1167

>  <Formula> (1,414)
C15H13Cl2NO3

>  <MolWeight> (1,414)
326.17462

>  <PCAT_CMPD_ID> (1,414)
CL-415033

>  <CNC_ID> (1,414)
359326736

>  <transfer_container_id> (1,414)
PTN000000067

>  <COMPOUND_NUMBER> (1,414)
CL-415033

>  <BAR_CODE_NO> (1,414)
3917583

>  <LOCATION_CODE> (1,414)
PTNCS

>  <AMOUNT_CURRENT> (1,414)
33.8

$$$$
WAY-312324
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,415)
1168

>  <Formula> (1,415)
C21H30N2O3

>  <MolWeight> (1,415)
358.4745

>  <PCAT_CMPD_ID> (1,415)
WAY-312324

>  <CNC_ID> (1,415)
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>  <transfer_container_id> (1,415)
PTN000000065

>  <COMPOUND_NUMBER> (1,415)
WAY-312324

>  <BAR_CODE_NO> (1,415)
3916944

>  <LOCATION_CODE> (1,415)
PTNCS

>  <AMOUNT_CURRENT> (1,415)
33.4

$$$$
WAY-310710
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,416)
1169

>  <Formula> (1,416)
C14H18FNO2

>  <MolWeight> (1,416)
251.2966232

>  <PCAT_CMPD_ID> (1,416)
WAY-310710

>  <CNC_ID> (1,416)
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>  <transfer_container_id> (1,416)
PTN000000065

>  <COMPOUND_NUMBER> (1,416)
WAY-310710

>  <BAR_CODE_NO> (1,416)
3914965

>  <LOCATION_CODE> (1,416)
PTNCS

>  <AMOUNT_CURRENT> (1,416)
33

$$$$
WAY-311461
csChFnd80/10111816222D

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  8 11  2  0  0  0  0
 10 14  1  0  0  0  0
 17 22  1  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,417)
1170

>  <Formula> (1,417)
C18H13NO4

>  <MolWeight> (1,417)
307.30012

>  <PCAT_CMPD_ID> (1,417)
WAY-311461

>  <CNC_ID> (1,417)
359315202

>  <transfer_container_id> (1,417)
PTN000000065

>  <COMPOUND_NUMBER> (1,417)
WAY-311461

>  <BAR_CODE_NO> (1,417)
3915850

>  <LOCATION_CODE> (1,417)
PTNCS

>  <AMOUNT_CURRENT> (1,417)
33

$$$$
WAY-312497
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  3  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 17 20  2  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
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 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
  9 12  2  0  0  0  0
 15 16  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,418)
1171

>  <Formula> (1,418)
C19H22N2O4S

>  <MolWeight> (1,418)
374.45398

>  <PCAT_CMPD_ID> (1,418)
WAY-312497

>  <CNC_ID> (1,418)
359316237

>  <transfer_container_id> (1,418)
PTN000000065

>  <COMPOUND_NUMBER> (1,418)
WAY-312497

>  <BAR_CODE_NO> (1,418)
3917139

>  <LOCATION_CODE> (1,418)
PTNCS

>  <AMOUNT_CURRENT> (1,418)
33.6

$$$$
WAY-310313
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 17 18  1  0  0  0  0
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 18 20  2  0  0  0  0
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 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,419)
1172

>  <Formula> (1,419)
C20H25N3O2

>  <MolWeight> (1,419)
339.4314

>  <PCAT_CMPD_ID> (1,419)
WAY-310313

>  <CNC_ID> (1,419)
359314054

>  <transfer_container_id> (1,419)
PTN000000065

>  <COMPOUND_NUMBER> (1,419)
WAY-310313

>  <BAR_CODE_NO> (1,419)
3914517

>  <LOCATION_CODE> (1,419)
PTNCS

>  <AMOUNT_CURRENT> (1,419)
33.9

$$$$
WAY-310312
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 12 17  1  0  0  0  0
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 16 19  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,420)
1173

>  <Formula> (1,420)
C27H30N2O4

>  <MolWeight> (1,420)
446.5381

>  <PCAT_CMPD_ID> (1,420)
WAY-310312

>  <CNC_ID> (1,420)
359314053

>  <transfer_container_id> (1,420)
PTN000000065

>  <COMPOUND_NUMBER> (1,420)
WAY-310312

>  <BAR_CODE_NO> (1,420)
3914516

>  <LOCATION_CODE> (1,420)
PTNCS

>  <AMOUNT_CURRENT> (1,420)
33.5

$$$$
WAY-310707-A
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,421)
1174

>  <Formula> (1,421)
C14H21NO2

>  <MolWeight> (1,421)
235.32204

>  <PCAT_CMPD_ID> (1,421)
WAY-310707-A

>  <CNC_ID> (1,421)
359314448

>  <transfer_container_id> (1,421)
PTN000000065

>  <COMPOUND_NUMBER> (1,421)
WAY-310707-A

>  <BAR_CODE_NO> (1,421)
3914960

>  <LOCATION_CODE> (1,421)
PTNCS

>  <AMOUNT_CURRENT> (1,421)
33

$$$$
WAY-345592
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  7  1  0  0  0  0
 12  1  2  0  0  0  0
 13  2  2  0  0  0  0
 14 11  1  0  0  0  0
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 16  3  1  0  0  0  0
 17  3  1  0  0  0  0
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 11  9  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,422)
1175

>  <Formula> (1,422)
C16H22N2O4

>  <MolWeight> (1,422)
306.35688

>  <PCAT_CMPD_ID> (1,422)
WAY-345592

>  <CNC_ID> (1,422)
359320849

>  <transfer_container_id> (1,422)
PTN000000065

>  <COMPOUND_NUMBER> (1,422)
WAY-345592

>  <BAR_CODE_NO> (1,422)
2555843

>  <LOCATION_CODE> (1,422)
PTNCS

>  <AMOUNT_CURRENT> (1,422)
32.8

$$$$
WAY-345594
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  7  1  0  0  0  0
 12  1  1  0  0  0  0
 13  1  1  0  0  0  0
 14  2  2  0  0  0  0
 15  3  2  0  0  0  0
 16 13  1  0  0  0  0
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 18 11  1  0  0  0  0
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 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
 17 20  1  0  0  0  0
 11  9  2  0  0  0  0
M  END
>  <Mol_ID> (1,423)
1176

>  <Formula> (1,423)
C17H24N2O4

>  <MolWeight> (1,423)
320.38346

>  <PCAT_CMPD_ID> (1,423)
WAY-345594

>  <CNC_ID> (1,423)
359320851

>  <transfer_container_id> (1,423)
PTN000000065

>  <COMPOUND_NUMBER> (1,423)
WAY-345594

>  <BAR_CODE_NO> (1,423)
2555800

>  <LOCATION_CODE> (1,423)
PTNCS

>  <AMOUNT_CURRENT> (1,423)
33

$$$$
WAY-312993-A
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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 13 14  1  0  0  0  0
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 17 19  1  0  0  0  0
  6  8  1  0  0  0  0
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,424)
1177

>  <Formula> (1,424)
C16H17NO2

>  <MolWeight> (1,424)
255.31168

>  <PCAT_CMPD_ID> (1,424)
WAY-312993-A

>  <CNC_ID> (1,424)
359328030

>  <transfer_container_id> (1,424)
PTN000000067

>  <COMPOUND_NUMBER> (1,424)
WAY-312993-A

>  <BAR_CODE_NO> (1,424)
3917760

>  <LOCATION_CODE> (1,424)
PTNCS

>  <AMOUNT_CURRENT> (1,424)
33.4

$$$$
WAY-311712
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    2.9414    0.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (1,425)
1178

>  <Formula> (1,425)
C17H17NO4

>  <MolWeight> (1,425)
299.32118

>  <PCAT_CMPD_ID> (1,425)
WAY-311712

>  <CNC_ID> (1,425)
359315453

>  <transfer_container_id> (1,425)
PTN000000065

>  <COMPOUND_NUMBER> (1,425)
WAY-311712

>  <BAR_CODE_NO> (1,425)
3916185

>  <LOCATION_CODE> (1,425)
PTNCS

>  <AMOUNT_CURRENT> (1,425)
33.6

$$$$
CL-84745
csChFnd80/10111816222D

  9  9  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,426)
1179

>  <Formula> (1,426)
C3H3N3O2S

>  <MolWeight> (1,426)
145.13982

>  <PCAT_CMPD_ID> (1,426)
CL-84745

>  <CNC_ID> (1,426)
359313643

>  <transfer_container_id> (1,426)
PTN000000065

>  <COMPOUND_NUMBER> (1,426)
CL-84745

>  <BAR_CODE_NO> (1,426)
3917189

>  <LOCATION_CODE> (1,426)
PTNCS

>  <AMOUNT_CURRENT> (1,426)
33.4

$$$$
CL-430760
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 13 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,427)
1180

>  <Formula> (1,427)
C20H25N3O

>  <MolWeight> (1,427)
323.432

>  <PCAT_CMPD_ID> (1,427)
CL-430760

>  <CNC_ID> (1,427)
359326760

>  <transfer_container_id> (1,427)
PTN000000067

>  <COMPOUND_NUMBER> (1,427)
CL-430760

>  <BAR_CODE_NO> (1,427)
3917667

>  <LOCATION_CODE> (1,427)
PTNCS

>  <AMOUNT_CURRENT> (1,427)
33.1

$$$$
WAY-239809
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
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  9 10  1  0  0  0  0
 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  1  0  0  0  0
 15  8  1  0  0  0  0
 16  9  1  0  0  0  0
 17 19  1  0  0  0  0
 18 12  1  0  0  0  0
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 20 14  1  0  0  0  0
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 22 15  2  0  0  0  0
 23 16  2  0  0  0  0
  8  9  2  0  0  0  0
  6  5  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,428)
1181

>  <Formula> (1,428)
C18H23N3O2

>  <MolWeight> (1,428)
313.39412

>  <PCAT_CMPD_ID> (1,428)
WAY-239809

>  <CNC_ID> (1,428)
359313972

>  <transfer_container_id> (1,428)
PTN000000065

>  <COMPOUND_NUMBER> (1,428)
WAY-239809

>  <BAR_CODE_NO> (1,428)
3916619

>  <LOCATION_CODE> (1,428)
PTNCS

>  <AMOUNT_CURRENT> (1,428)
33.8

$$$$
WAY-345253
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
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  8  2  2  0  0  0  0
  9 13  1  0  0  0  0
 10  3  2  0  0  0  0
 11  4  1  0  0  0  0
 12  4  1  0  0  0  0
 13 16  1  0  0  0  0
 14  6  1  0  0  0  0
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 16 18  2  0  0  0  0
 17 14  2  0  0  0  0
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 20 11  2  0  0  0  0
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 22 12  1  0  0  0  0
 23 20  1  0  0  0  0
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 25 22  2  0  0  0  0
 26 19  1  0  0  0  0
 27 24  1  0  0  0  0
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  5  4  1  0  0  0  0
 15 13  2  0  0  0  0
 28 26  2  0  0  0  0
 27 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,429)
1182

>  <Formula> (1,429)
C23H17N3O2

>  <MolWeight> (1,429)
367.39998

>  <PCAT_CMPD_ID> (1,429)
WAY-345253

>  <CNC_ID> (1,429)
359320545

>  <transfer_container_id> (1,429)
PTN000000065

>  <COMPOUND_NUMBER> (1,429)
WAY-345253

>  <BAR_CODE_NO> (1,429)
2555484

>  <LOCATION_CODE> (1,429)
PTNCS

>  <AMOUNT_CURRENT> (1,429)
32.3

$$$$
WAY-345401
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
   15.8750   -9.9542    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  9  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  2  0  0  0  0
  7  5  2  0  0  0  0
  8  3  2  0  0  0  0
  9  2  1  0  0  0  0
 10 11  1  0  0  0  0
 11  3  1  0  0  0  0
 12 10  1  0  0  0  0
 13 17  2  0  0  0  0
 14 12  1  0  0  0  0
 15 12  2  0  0  0  0
 16 14  2  0  0  0  0
 17 15  1  0  0  0  0
 18 13  1  0  0  0  0
  6  7  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,430)
1183

>  <Formula> (1,430)
C14H15NO2S

>  <MolWeight> (1,430)
261.3394

>  <PCAT_CMPD_ID> (1,430)
WAY-345401

>  <CNC_ID> (1,430)
359320671

>  <transfer_container_id> (1,430)
PTN000000065

>  <COMPOUND_NUMBER> (1,430)
WAY-345401

>  <BAR_CODE_NO> (1,430)
2555596

>  <LOCATION_CODE> (1,430)
PTNCS

>  <AMOUNT_CURRENT> (1,430)
32.6

$$$$
WAY-310584
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    1.2724    1.5793    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 17 18  1  0  0  0  0
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 18 20  2  0  0  0  0
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 24 25  1  0  0  0  0
  8 11  1  0  0  0  0
 12 13  2  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,431)
1184

>  <Formula> (1,431)
C18H20N2O4S

>  <MolWeight> (1,431)
360.4274

>  <PCAT_CMPD_ID> (1,431)
WAY-310584

>  <CNC_ID> (1,431)
359314325

>  <transfer_container_id> (1,431)
PTN000000065

>  <COMPOUND_NUMBER> (1,431)
WAY-310584

>  <BAR_CODE_NO> (1,431)
3914818

>  <LOCATION_CODE> (1,431)
PTNCS

>  <AMOUNT_CURRENT> (1,431)
33.5

$$$$
WAY-310386
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  5 10  2  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
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 17 20  1  0  0  0  0
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 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
  9 12  1  0  0  0  0
 14 16  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,432)
1185

>  <Formula> (1,432)
C17H24N2O5S

>  <MolWeight> (1,432)
368.44786

>  <PCAT_CMPD_ID> (1,432)
WAY-310386

>  <CNC_ID> (1,432)
359314127

>  <transfer_container_id> (1,432)
PRL000000080

>  <COMPOUND_NUMBER> (1,432)
WAY-310386

>  <BAR_CODE_NO> (1,432)
3944600

>  <LOCATION_CODE> (1,432)
PRLCS

>  <AMOUNT_CURRENT> (1,432)
33.5

$$$$
GI-522728
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,433)
1186

>  <Formula> (1,433)
C18H23NO5

>  <MolWeight> (1,433)
333.37892

>  <PCAT_CMPD_ID> (1,433)
GI-522728

>  <CNC_ID> (1,433)
359313650

>  <transfer_container_id> (1,433)
PTN000000065

>  <COMPOUND_NUMBER> (1,433)
GI-522728

>  <BAR_CODE_NO> (1,433)
3915140

>  <LOCATION_CODE> (1,433)
PTNCS

>  <AMOUNT_CURRENT> (1,433)
33.4

$$$$
WAY-311613
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 12 17  1  0  0  0  0
 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,434)
1187

>  <Formula> (1,434)
C16H12N2O3

>  <MolWeight> (1,434)
280.27808

>  <PCAT_CMPD_ID> (1,434)
WAY-311613

>  <CNC_ID> (1,434)
359315354

>  <transfer_container_id> (1,434)
PTN000000065

>  <COMPOUND_NUMBER> (1,434)
WAY-311613

>  <BAR_CODE_NO> (1,434)
3916042

>  <LOCATION_CODE> (1,434)
PTNCS

>  <AMOUNT_CURRENT> (1,434)
33.3

$$$$
WAY-311808
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 13 19  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,435)
1188

>  <Formula> (1,435)
C19H21NO5

>  <MolWeight> (1,435)
343.37374

>  <PCAT_CMPD_ID> (1,435)
WAY-311808

>  <CNC_ID> (1,435)
359315549

>  <transfer_container_id> (1,435)
PTN000000065

>  <COMPOUND_NUMBER> (1,435)
WAY-311808

>  <BAR_CODE_NO> (1,435)
3916313

>  <LOCATION_CODE> (1,435)
PTNCS

>  <AMOUNT_CURRENT> (1,435)
33.7

$$$$
CL-414603
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 20 22  2  0  0  0  0
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 15 16  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,436)
1189

>  <Formula> (1,436)
C15H11ClN2O2S2

>  <MolWeight> (1,436)
350.84304

>  <PCAT_CMPD_ID> (1,436)
CL-414603

>  <CNC_ID> (1,436)
359313607

>  <transfer_container_id> (1,436)
PTN000000065

>  <COMPOUND_NUMBER> (1,436)
CL-414603

>  <BAR_CODE_NO> (1,436)
3915146

>  <LOCATION_CODE> (1,436)
PTNCS

>  <AMOUNT_CURRENT> (1,436)
33.6

$$$$
WAY-345661
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 28  6  1  0  0  0  0
 29 26  1  0  0  0  0
 30 31  1  0  0  0  0
 31 28  2  0  0  0  0
 32 23  1  0  0  0  0
 33 22  1  0  0  0  0
 17 22  1  0  0  0  0
 30 18  2  0  0  0  0
  3  5  1  0  0  0  0
 13 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,437)
1190

>  <Formula> (1,437)
C23H23NO8S

>  <MolWeight> (1,437)
473.49562

>  <PCAT_CMPD_ID> (1,437)
WAY-345661

>  <CNC_ID> (1,437)
359320881

>  <transfer_container_id> (1,437)
PTN000000065

>  <COMPOUND_NUMBER> (1,437)
WAY-345661

>  <BAR_CODE_NO> (1,437)
2555865

>  <LOCATION_CODE> (1,437)
PTNCS

>  <AMOUNT_CURRENT> (1,437)
32.9

$$$$
WAY-312229
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
M  END
>  <Mol_ID> (1,438)
1191

>  <Formula> (1,438)
C13H15N3O4

>  <MolWeight> (1,438)
277.2759

>  <PCAT_CMPD_ID> (1,438)
WAY-312229

>  <CNC_ID> (1,438)
359315969

>  <transfer_container_id> (1,438)
PTN000000065

>  <COMPOUND_NUMBER> (1,438)
WAY-312229

>  <BAR_CODE_NO> (1,438)
3916829

>  <LOCATION_CODE> (1,438)
PTNCS

>  <AMOUNT_CURRENT> (1,438)
33.4

$$$$
WAY-312517
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -0.7069    0.2448    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 10 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  2  0  0  0  0
 19 21  2  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
  9 13  1  0  0  0  0
 12 16  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,439)
1192

>  <Formula> (1,439)
C19H19Br2NO3

>  <MolWeight> (1,439)
469.16706

>  <PCAT_CMPD_ID> (1,439)
WAY-312517

>  <CNC_ID> (1,439)
359316256

>  <transfer_container_id> (1,439)
PTN000000065

>  <COMPOUND_NUMBER> (1,439)
WAY-312517

>  <BAR_CODE_NO> (1,439)
3917164

>  <LOCATION_CODE> (1,439)
PTNCS

>  <AMOUNT_CURRENT> (1,439)
33.5

$$$$
WAY-312733
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -0.4897    0.0862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
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  3  8  1  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
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 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
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 13 19  2  0  0  0  0
 14 20  2  0  0  0  0
 16 21  1  0  0  0  0
 16 22  2  0  0  0  0
 17 23  2  0  0  0  0
 18 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
  5  9  2  0  0  0  0
  8 11  1  0  0  0  0
 15 20  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,440)
1193

>  <Formula> (1,440)
C20H20N2O4

>  <MolWeight> (1,440)
352.3838

>  <PCAT_CMPD_ID> (1,440)
WAY-312733

>  <CNC_ID> (1,440)
359327770

>  <transfer_container_id> (1,440)
PTN000000067

>  <COMPOUND_NUMBER> (1,440)
WAY-312733

>  <BAR_CODE_NO> (1,440)
3917422

>  <LOCATION_CODE> (1,440)
PTNCS

>  <AMOUNT_CURRENT> (1,440)
33.6

$$$$
WAY-345414
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
    7.5292   -3.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3 10  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  3  1  0  0  0  0
 14  4  1  0  0  0  0
 15 18  1  0  0  0  0
 16  2  1  0  0  0  0
 17  9  1  0  0  0  0
 18 13  2  0  0  0  0
 19 15  1  0  0  0  0
 20 17  1  0  0  0  0
 21  5  1  0  0  0  0
 22 21  2  0  0  0  0
 23 22  1  0  0  0  0
 24 20  1  0  0  0  0
 23 17  2  0  0  0  0
  6 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,441)
1194

>  <Formula> (1,441)
C17H15ClFNO4

>  <MolWeight> (1,441)
351.7567032

>  <PCAT_CMPD_ID> (1,441)
WAY-345414

>  <CNC_ID> (1,441)
359320684

>  <transfer_container_id> (1,441)
PTN000000065

>  <COMPOUND_NUMBER> (1,441)
WAY-345414

>  <BAR_CODE_NO> (1,441)
2555612

>  <LOCATION_CODE> (1,441)
PTNCS

>  <AMOUNT_CURRENT> (1,441)
32.7

$$$$
GI-555584
csChFnd80/10111816222D

 15 17  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 11 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,442)
1195

>  <Formula> (1,442)
C13H13NO

>  <MolWeight> (1,442)
199.24842

>  <PCAT_CMPD_ID> (1,442)
GI-555584

>  <CNC_ID> (1,442)
359326779

>  <transfer_container_id> (1,442)
PTN000000067

>  <COMPOUND_NUMBER> (1,442)
GI-555584

>  <BAR_CODE_NO> (1,442)
3917352

>  <LOCATION_CODE> (1,442)
PTNCS

>  <AMOUNT_CURRENT> (1,442)
33.8

$$$$
CL-394897
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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 10 19  1  0  0  0  0
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 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
  7 11  1  0  0  0  0
 19 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,443)
1196

>  <Formula> (1,443)
C19H24N2O4

>  <MolWeight> (1,443)
344.40486

>  <PCAT_CMPD_ID> (1,443)
CL-394897

>  <CNC_ID> (1,443)
359313585

>  <transfer_container_id> (1,443)
PTN000000065

>  <COMPOUND_NUMBER> (1,443)
CL-394897

>  <BAR_CODE_NO> (1,443)
3916123

>  <LOCATION_CODE> (1,443)
PTNCS

>  <AMOUNT_CURRENT> (1,443)
33.4

$$$$
WAY-312800
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
  9 10  2  0  0  0  0
 14 16  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,444)
1197

>  <Formula> (1,444)
C19H15N3O

>  <MolWeight> (1,444)
301.3419

>  <PCAT_CMPD_ID> (1,444)
WAY-312800

>  <CNC_ID> (1,444)
359327837

>  <transfer_container_id> (1,444)
PTN000000067

>  <COMPOUND_NUMBER> (1,444)
WAY-312800

>  <BAR_CODE_NO> (1,444)
3917510

>  <LOCATION_CODE> (1,444)
PTNCS

>  <AMOUNT_CURRENT> (1,444)
33.8

$$$$
WAY-311502
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 14 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  8 11  2  0  0  0  0
  9 10  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,445)
1198

>  <Formula> (1,445)
C17H16N2O4

>  <MolWeight> (1,445)
312.31994

>  <PCAT_CMPD_ID> (1,445)
WAY-311502

>  <CNC_ID> (1,445)
359315243

>  <transfer_container_id> (1,445)
PTN000000065

>  <COMPOUND_NUMBER> (1,445)
WAY-311502

>  <BAR_CODE_NO> (1,445)
3915895

>  <LOCATION_CODE> (1,445)
PTNCS

>  <AMOUNT_CURRENT> (1,445)
33.7

$$$$
WAY-343867
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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  3  2  1  0  0  0  0
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  6 16  1  0  0  0  0
  7  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  3  2  0  0  0  0
 12  4  2  0  0  0  0
 13  6  2  0  0  0  0
 14 17  1  0  0  0  0
 15  5  1  0  0  0  0
 16  9  1  0  0  0  0
 17  7  2  0  0  0  0
 18 10  1  0  0  0  0
 19 14  1  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 20  2  0  0  0  0
 23 21  2  0  0  0  0
 24 22  1  0  0  0  0
 25 24  2  0  0  0  0
  8 14  2  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,446)
1199

>  <Formula> (1,446)
C17H16ClN3O4

>  <MolWeight> (1,446)
361.77964

>  <PCAT_CMPD_ID> (1,446)
WAY-343867

>  <CNC_ID> (1,446)
359319208

>  <transfer_container_id> (1,446)
PTN000000065

>  <COMPOUND_NUMBER> (1,446)
WAY-343867

>  <BAR_CODE_NO> (1,446)
2554031

>  <LOCATION_CODE> (1,446)
PTNCS

>  <AMOUNT_CURRENT> (1,446)
32.9

$$$$
WAY-342692
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   11.1042  -10.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  1  0  0  0  0
 11  7  1  0  0  0  0
 12  4  1  0  0  0  0
 13 11  2  0  0  0  0
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 23 21  1  0  0  0  0
  6  5  1  0  0  0  0
 22 23  2  0  0  0  0
 14 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,447)
1200

>  <Formula> (1,447)
C15H11ClN2O3S2

>  <MolWeight> (1,447)
366.84244

>  <PCAT_CMPD_ID> (1,447)
WAY-342692

>  <CNC_ID> (1,447)
359318946

>  <transfer_container_id> (1,447)
PTN000000065

>  <COMPOUND_NUMBER> (1,447)
WAY-342692

>  <BAR_CODE_NO> (1,447)
2555066

>  <LOCATION_CODE> (1,447)
PTNCS

>  <AMOUNT_CURRENT> (1,447)
32.3

$$$$
WAY-311097
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
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 19 20  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,448)
1201

>  <Formula> (1,448)
C16H15FN2O

>  <MolWeight> (1,448)
270.3015032

>  <PCAT_CMPD_ID> (1,448)
WAY-311097

>  <CNC_ID> (1,448)
359314838

>  <transfer_container_id> (1,448)
PTN000000065

>  <COMPOUND_NUMBER> (1,448)
WAY-311097

>  <BAR_CODE_NO> (1,448)
3915445

>  <LOCATION_CODE> (1,448)
PTNCS

>  <AMOUNT_CURRENT> (1,448)
33.7

$$$$
WAY-345280
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  4  2  0  0  0  0
 12  6  1  0  0  0  0
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 17 15  2  0  0  0  0
 18 16  1  0  0  0  0
  8  7  1  0  0  0  0
 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,449)
1202

>  <Formula> (1,449)
C12H11BrN2O3

>  <MolWeight> (1,449)
311.13134

>  <PCAT_CMPD_ID> (1,449)
WAY-345280

>  <CNC_ID> (1,449)
359320573

>  <transfer_container_id> (1,449)
PTN000000065

>  <COMPOUND_NUMBER> (1,449)
WAY-345280

>  <BAR_CODE_NO> (1,449)
2555509

>  <LOCATION_CODE> (1,449)
PTNCS

>  <AMOUNT_CURRENT> (1,449)
32.6

$$$$
WAY-344231
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
   11.3667   -8.8917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  8  1  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
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 20  1  1  0  0  0  0
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 30 19  1  0  0  0  0
 29 27  1  0  0  0  0
  8 16  1  0  0  0  0
 33 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,450)
1203

>  <Formula> (1,450)
C26H25N3O4

>  <MolWeight> (1,450)
443.4944

>  <PCAT_CMPD_ID> (1,450)
WAY-344231

>  <CNC_ID> (1,450)
359319569

>  <transfer_container_id> (1,450)
PTN000000065

>  <COMPOUND_NUMBER> (1,450)
WAY-344231

>  <BAR_CODE_NO> (1,450)
2554579

>  <LOCATION_CODE> (1,450)
PTNCS

>  <AMOUNT_CURRENT> (1,450)
33

$$$$
WAY-310660
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,451)
1204

>  <Formula> (1,451)
C20H20F2N2O3

>  <MolWeight> (1,451)
374.3812064

>  <PCAT_CMPD_ID> (1,451)
WAY-310660

>  <CNC_ID> (1,451)
359314401

>  <transfer_container_id> (1,451)
PTN000000065

>  <COMPOUND_NUMBER> (1,451)
WAY-310660

>  <BAR_CODE_NO> (1,451)
3914906

>  <LOCATION_CODE> (1,451)
PTNCS

>  <AMOUNT_CURRENT> (1,451)
33.7

$$$$
WAY-310298
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,452)
1205

>  <Formula> (1,452)
C21H22F2N2O3

>  <MolWeight> (1,452)
388.4077864

>  <PCAT_CMPD_ID> (1,452)
WAY-310298

>  <CNC_ID> (1,452)
359314039

>  <transfer_container_id> (1,452)
PTN000000065

>  <COMPOUND_NUMBER> (1,452)
WAY-310298

>  <BAR_CODE_NO> (1,452)
3914499

>  <LOCATION_CODE> (1,452)
PTNCS

>  <AMOUNT_CURRENT> (1,452)
33.4

$$$$
WAY-312231
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 14  8  1  0  0  0  0
 15  3  1  0  0  0  0
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 17  2  2  0  0  0  0
 18  6  1  0  0  0  0
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 13  3  1  0  0  0  0
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  5  7  1  0  0  0  0
  9 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,453)
1206

>  <Formula> (1,453)
C20H20N2O3

>  <MolWeight> (1,453)
336.3844

>  <PCAT_CMPD_ID> (1,453)
WAY-312231

>  <CNC_ID> (1,453)
359315971

>  <transfer_container_id> (1,453)
PTN000000065

>  <COMPOUND_NUMBER> (1,453)
WAY-312231

>  <BAR_CODE_NO> (1,453)
3916831

>  <LOCATION_CODE> (1,453)
PTNCS

>  <AMOUNT_CURRENT> (1,453)
33.5

$$$$
WAY-311683
csChFnd80/10111816222D

 33 35  0  0  0  0  0  0  0  0999 V2000
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 11  5  2  0  0  0  0
 12  2  1  0  0  0  0
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 20  6  1  0  0  0  0
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 14 24  2  0  0  0  0
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M  END
>  <Mol_ID> (1,454)
1207

>  <Formula> (1,454)
C24H23N3O5S

>  <MolWeight> (1,454)
465.52152

>  <PCAT_CMPD_ID> (1,454)
WAY-311683

>  <CNC_ID> (1,454)
359315424

>  <transfer_container_id> (1,454)
PTN000000065

>  <COMPOUND_NUMBER> (1,454)
WAY-311683

>  <BAR_CODE_NO> (1,454)
3916143

>  <LOCATION_CODE> (1,454)
PTNCS

>  <AMOUNT_CURRENT> (1,454)
33.8

$$$$
GI-526137
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,455)
1208

>  <Formula> (1,455)
C10H9BrN2O3

>  <MolWeight> (1,455)
285.09406

>  <PCAT_CMPD_ID> (1,455)
GI-526137

>  <CNC_ID> (1,455)
359313654

>  <transfer_container_id> (1,455)
PTN000000065

>  <COMPOUND_NUMBER> (1,455)
GI-526137

>  <BAR_CODE_NO> (1,455)
3915914

>  <LOCATION_CODE> (1,455)
PTNCS

>  <AMOUNT_CURRENT> (1,455)
33.5

$$$$
WAY-344089
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
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 30 26  2  0  0  0  0
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M  END
>  <Mol_ID> (1,456)
1209

>  <Formula> (1,456)
C21H21N3O6

>  <MolWeight> (1,456)
411.40794

>  <PCAT_CMPD_ID> (1,456)
WAY-344089

>  <CNC_ID> (1,456)
359319425

>  <transfer_container_id> (1,456)
PTN000000065

>  <COMPOUND_NUMBER> (1,456)
WAY-344089

>  <BAR_CODE_NO> (1,456)
2554251

>  <LOCATION_CODE> (1,456)
PTNCS

>  <AMOUNT_CURRENT> (1,456)
32.7

$$$$
WAY-344442
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 23  4  1  0  0  0  0
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M  END
>  <Mol_ID> (1,457)
1210

>  <Formula> (1,457)
C20H24N4O5S

>  <MolWeight> (1,457)
432.49336

>  <PCAT_CMPD_ID> (1,457)
WAY-344442

>  <CNC_ID> (1,457)
359319776

>  <transfer_container_id> (1,457)
PTN000000065

>  <COMPOUND_NUMBER> (1,457)
WAY-344442

>  <BAR_CODE_NO> (1,457)
2554668

>  <LOCATION_CODE> (1,457)
PTNCS

>  <AMOUNT_CURRENT> (1,457)
32.5

$$$$
WAY-313340
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 14 16  1  0  0  0  0
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M  END
>  <Mol_ID> (1,458)
1211

>  <Formula> (1,458)
C18H20N2O4S

>  <MolWeight> (1,458)
360.4274

>  <PCAT_CMPD_ID> (1,458)
WAY-313340

>  <CNC_ID> (1,458)
359328376

>  <transfer_container_id> (1,458)
PTN000000067

>  <COMPOUND_NUMBER> (1,458)
WAY-313340

>  <BAR_CODE_NO> (1,458)
3918217

>  <LOCATION_CODE> (1,458)
PTNCS

>  <AMOUNT_CURRENT> (1,458)
33.1

$$$$
WAY-312891
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 24 25  1  0  0  0  0
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 15 18  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,459)
1212

>  <Formula> (1,459)
C19H22N2O3S

>  <MolWeight> (1,459)
358.45458

>  <PCAT_CMPD_ID> (1,459)
WAY-312891

>  <CNC_ID> (1,459)
359327928

>  <transfer_container_id> (1,459)
PTN000000067

>  <COMPOUND_NUMBER> (1,459)
WAY-312891

>  <BAR_CODE_NO> (1,459)
3917620

>  <LOCATION_CODE> (1,459)
PTNCS

>  <AMOUNT_CURRENT> (1,459)
33.7

$$$$
WAY-312806
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12 19  1  0  0  0  0
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M  END
>  <Mol_ID> (1,460)
1213

>  <Formula> (1,460)
C22H26N2O2

>  <MolWeight> (1,460)
350.45404

>  <PCAT_CMPD_ID> (1,460)
WAY-312806

>  <CNC_ID> (1,460)
359327843

>  <transfer_container_id> (1,460)
PTN000000067

>  <COMPOUND_NUMBER> (1,460)
WAY-312806

>  <BAR_CODE_NO> (1,460)
3917521

>  <LOCATION_CODE> (1,460)
PTNCS

>  <AMOUNT_CURRENT> (1,460)
33.7

$$$$
WAY-311510
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  7 12  1  0  0  0  0
  9 14  1  0  0  0  0
 20 22  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,461)
1214

>  <Formula> (1,461)
C21H19FN2O3

>  <MolWeight> (1,461)
366.3855632

>  <PCAT_CMPD_ID> (1,461)
WAY-311510

>  <CNC_ID> (1,461)
359315251

>  <transfer_container_id> (1,461)
PTN000000065

>  <COMPOUND_NUMBER> (1,461)
WAY-311510

>  <BAR_CODE_NO> (1,461)
3915903

>  <LOCATION_CODE> (1,461)
PTNCS

>  <AMOUNT_CURRENT> (1,461)
33.7

$$$$
WAY-240663
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10 12  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,462)
1215

>  <Formula> (1,462)
C21H27N3O2

>  <MolWeight> (1,462)
353.45798

>  <PCAT_CMPD_ID> (1,462)
WAY-240663

>  <CNC_ID> (1,462)
359313990

>  <transfer_container_id> (1,462)
PTN000000065

>  <COMPOUND_NUMBER> (1,462)
WAY-240663

>  <BAR_CODE_NO> (1,462)
3915380

>  <LOCATION_CODE> (1,462)
PTNCS

>  <AMOUNT_CURRENT> (1,462)
33.5

$$$$
WAY-310869
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11 15  2  0  0  0  0
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 19 20  1  0  0  0  0
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 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,463)
1216

>  <Formula> (1,463)
C16H19NO3

>  <MolWeight> (1,463)
273.32696

>  <PCAT_CMPD_ID> (1,463)
WAY-310869

>  <CNC_ID> (1,463)
359314611

>  <transfer_container_id> (1,463)
PTN000000065

>  <COMPOUND_NUMBER> (1,463)
WAY-310869

>  <BAR_CODE_NO> (1,463)
3915161

>  <LOCATION_CODE> (1,463)
PTNCS

>  <AMOUNT_CURRENT> (1,463)
33.8

$$$$
WAY-311436
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 15 18  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,464)
1217

>  <Formula> (1,464)
C18H18N2O3

>  <MolWeight> (1,464)
310.34712

>  <PCAT_CMPD_ID> (1,464)
WAY-311436

>  <CNC_ID> (1,464)
359315177

>  <transfer_container_id> (1,464)
PTN000000065

>  <COMPOUND_NUMBER> (1,464)
WAY-311436

>  <BAR_CODE_NO> (1,464)
3915822

>  <LOCATION_CODE> (1,464)
PTNCS

>  <AMOUNT_CURRENT> (1,464)
33.8

$$$$
WAY-310385
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 29 30  1  0  0  0  0
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 18 20  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,465)
1218

>  <Formula> (1,465)
C22H25BrN2O5

>  <MolWeight> (1,465)
477.3483

>  <PCAT_CMPD_ID> (1,465)
WAY-310385

>  <CNC_ID> (1,465)
359314126

>  <transfer_container_id> (1,465)
PTN000000065

>  <COMPOUND_NUMBER> (1,465)
WAY-310385

>  <BAR_CODE_NO> (1,465)
3914599

>  <LOCATION_CODE> (1,465)
PTNCS

>  <AMOUNT_CURRENT> (1,465)
33.2

$$$$
WAY-311872
csChFnd80/10111816222D

 32 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,466)
1219

>  <Formula> (1,466)
C24H28N2O6

>  <MolWeight> (1,466)
440.48892

>  <PCAT_CMPD_ID> (1,466)
WAY-311872

>  <CNC_ID> (1,466)
359315613

>  <transfer_container_id> (1,466)
PTN000000065

>  <COMPOUND_NUMBER> (1,466)
WAY-311872

>  <BAR_CODE_NO> (1,466)
3916394

>  <LOCATION_CODE> (1,466)
PTNCS

>  <AMOUNT_CURRENT> (1,466)
33.5

$$$$
SD-9741
csChFnd80/10111816222D

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 10 13  1  0  0  0  0
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M  END
>  <Mol_ID> (1,467)
1220

>  <Formula> (1,467)
C9H7Cl2N5O

>  <MolWeight> (1,467)
272.09078

>  <PCAT_CMPD_ID> (1,467)
SD-9741

>  <CNC_ID> (1,467)
359326809

>  <transfer_container_id> (1,467)
PTN000000067

>  <COMPOUND_NUMBER> (1,467)
SD-9741

>  <BAR_CODE_NO> (1,467)
3917841

>  <LOCATION_CODE> (1,467)
PTNCS

>  <AMOUNT_CURRENT> (1,467)
33.2

$$$$
WAY-312798
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 21 24  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
 22 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,468)
1221

>  <Formula> (1,468)
C21H26N2O

>  <MolWeight> (1,468)
322.44394

>  <PCAT_CMPD_ID> (1,468)
WAY-312798

>  <CNC_ID> (1,468)
359327835

>  <transfer_container_id> (1,468)
PTN000000067

>  <COMPOUND_NUMBER> (1,468)
WAY-312798

>  <BAR_CODE_NO> (1,468)
3917508

>  <LOCATION_CODE> (1,468)
PTNCS

>  <AMOUNT_CURRENT> (1,468)
33.3

$$$$
WAY-242738
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
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 15  6  1  0  0  0  0
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M  END
>  <Mol_ID> (1,469)
1222

>  <Formula> (1,469)
C20H24N2O4

>  <MolWeight> (1,469)
356.41556

>  <PCAT_CMPD_ID> (1,469)
WAY-242738

>  <CNC_ID> (1,469)
359313998

>  <transfer_container_id> (1,469)
PTN000000065

>  <COMPOUND_NUMBER> (1,469)
WAY-242738

>  <BAR_CODE_NO> (1,469)
3916871

>  <LOCATION_CODE> (1,469)
PTNCS

>  <AMOUNT_CURRENT> (1,469)
33

$$$$
WAY-344243
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,470)
1223

>  <Formula> (1,470)
C24H20N4O3

>  <MolWeight> (1,470)
412.4406

>  <PCAT_CMPD_ID> (1,470)
WAY-344243

>  <CNC_ID> (1,470)
359319581

>  <transfer_container_id> (1,470)
PTN000000065

>  <COMPOUND_NUMBER> (1,470)
WAY-344243

>  <BAR_CODE_NO> (1,470)
2554626

>  <LOCATION_CODE> (1,470)
PTNCS

>  <AMOUNT_CURRENT> (1,470)
30.9

$$$$
WAY-344643
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 22  6  1  0  0  0  0
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 30 29  2  0  0  0  0
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M  END
>  <Mol_ID> (1,471)
1224

>  <Formula> (1,471)
C21H18Cl2FN3O3

>  <MolWeight> (1,471)
450.2903232

>  <PCAT_CMPD_ID> (1,471)
WAY-344643

>  <CNC_ID> (1,471)
359319960

>  <transfer_container_id> (1,471)
PTN000000065

>  <COMPOUND_NUMBER> (1,471)
WAY-344643

>  <BAR_CODE_NO> (1,471)
2554869

>  <LOCATION_CODE> (1,471)
PTNCS

>  <AMOUNT_CURRENT> (1,471)
32.4

$$$$
WAY-313286
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,472)
1225

>  <Formula> (1,472)
C23H21N3O3

>  <MolWeight> (1,472)
387.43114

>  <PCAT_CMPD_ID> (1,472)
WAY-313286

>  <CNC_ID> (1,472)
359328322

>  <transfer_container_id> (1,472)
PTN000000067

>  <COMPOUND_NUMBER> (1,472)
WAY-313286

>  <BAR_CODE_NO> (1,472)
3918144

>  <LOCATION_CODE> (1,472)
PTNCS

>  <AMOUNT_CURRENT> (1,472)
33.8

$$$$
WAY-114210
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,473)
1226

>  <Formula> (1,473)
C14H12ClN3O

>  <MolWeight> (1,473)
273.71758

>  <PCAT_CMPD_ID> (1,473)
WAY-114210

>  <CNC_ID> (1,473)
359313693

>  <transfer_container_id> (1,473)
PTN000000065

>  <COMPOUND_NUMBER> (1,473)
WAY-114210

>  <BAR_CODE_NO> (1,473)
3916672

>  <LOCATION_CODE> (1,473)
PTNCS

>  <AMOUNT_CURRENT> (1,473)
33.8

$$$$
WAY-244307
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,474)
1227

>  <Formula> (1,474)
C13H12N2O2

>  <MolWeight> (1,474)
228.24658

>  <PCAT_CMPD_ID> (1,474)
WAY-244307

>  <CNC_ID> (1,474)
359326920

>  <transfer_container_id> (1,474)
PTN000000067

>  <COMPOUND_NUMBER> (1,474)
WAY-244307

>  <BAR_CODE_NO> (1,474)
3918023

>  <LOCATION_CODE> (1,474)
PTNCS

>  <AMOUNT_CURRENT> (1,474)
33.8

$$$$
WAY-345090
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 25 20  2  0  0  0  0
 26 11  1  0  0  0  0
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 28 16  1  0  0  0  0
 29 16  2  0  0  0  0
 30 29  1  0  0  0  0
 31 28  2  0  0  0  0
 32 30  2  0  0  0  0
 23 25  1  0  0  0  0
  3  8  1  0  0  0  0
  2  4  1  0  0  0  0
 32 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,475)
1228

>  <Formula> (1,475)
C21H20N6O4S

>  <MolWeight> (1,475)
452.4863

>  <PCAT_CMPD_ID> (1,475)
WAY-345090

>  <CNC_ID> (1,475)
359320398

>  <transfer_container_id> (1,475)
PTN000000065

>  <COMPOUND_NUMBER> (1,475)
WAY-345090

>  <BAR_CODE_NO> (1,475)
2555352

>  <LOCATION_CODE> (1,475)
PTNCS

>  <AMOUNT_CURRENT> (1,475)
32.7

$$$$
WAY-311821
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11 13  1  0  0  0  0
 12  9  1  0  0  0  0
 13  7  1  0  0  0  0
 14 11  1  0  0  0  0
 15  8  2  0  0  0  0
 16 10  2  0  0  0  0
 17 10  1  0  0  0  0
 18  4  1  0  0  0  0
 19  6  1  0  0  0  0
 20 12  2  0  0  0  0
 21 14  2  0  0  0  0
 22 17  1  0  0  0  0
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 26 20  1  0  0  0  0
 27 21  1  0  0  0  0
  6  4  2  0  0  0  0
 23 24  1  0  0  0  0
 12 14  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (1,476)
1229

>  <Formula> (1,476)
C20H22N2O4S

>  <MolWeight> (1,476)
386.46468

>  <PCAT_CMPD_ID> (1,476)
WAY-311821

>  <CNC_ID> (1,476)
359315562

>  <transfer_container_id> (1,476)
PTN000000065

>  <COMPOUND_NUMBER> (1,476)
WAY-311821

>  <BAR_CODE_NO> (1,476)
3916328

>  <LOCATION_CODE> (1,476)
PTNCS

>  <AMOUNT_CURRENT> (1,476)
33.7

$$$$
WAY-310757
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 13 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
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 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,477)
1230

>  <Formula> (1,477)
C17H26N6O3

>  <MolWeight> (1,477)
362.42674

>  <PCAT_CMPD_ID> (1,477)
WAY-310757

>  <CNC_ID> (1,477)
359314498

>  <transfer_container_id> (1,477)
PTN000000065

>  <COMPOUND_NUMBER> (1,477)
WAY-310757

>  <BAR_CODE_NO> (1,477)
3915025

>  <LOCATION_CODE> (1,477)
PTNCS

>  <AMOUNT_CURRENT> (1,477)
33.7

$$$$
WAY-310764
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,478)
1231

>  <Formula> (1,478)
C17H26N6O3

>  <MolWeight> (1,478)
362.42674

>  <PCAT_CMPD_ID> (1,478)
WAY-310764

>  <CNC_ID> (1,478)
359314505

>  <transfer_container_id> (1,478)
PTN000000065

>  <COMPOUND_NUMBER> (1,478)
WAY-310764

>  <BAR_CODE_NO> (1,478)
3915032

>  <LOCATION_CODE> (1,478)
PTNCS

>  <AMOUNT_CURRENT> (1,478)
33

$$$$
WAY-311615
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 19 21  1  0  0  0  0
  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,479)
1232

>  <Formula> (1,479)
C13H19N5O3

>  <MolWeight> (1,479)
293.32166

>  <PCAT_CMPD_ID> (1,479)
WAY-311615

>  <CNC_ID> (1,479)
359315356

>  <transfer_container_id> (1,479)
PTN000000065

>  <COMPOUND_NUMBER> (1,479)
WAY-311615

>  <BAR_CODE_NO> (1,479)
3916044

>  <LOCATION_CODE> (1,479)
PTNCS

>  <AMOUNT_CURRENT> (1,479)
33

$$$$
WAY-311784
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,480)
1233

>  <Formula> (1,480)
C25H28N6O3

>  <MolWeight> (1,480)
460.52822

>  <PCAT_CMPD_ID> (1,480)
WAY-311784

>  <CNC_ID> (1,480)
359315525

>  <transfer_container_id> (1,480)
PTN000000065

>  <COMPOUND_NUMBER> (1,480)
WAY-311784

>  <BAR_CODE_NO> (1,480)
3916280

>  <LOCATION_CODE> (1,480)
PTNCS

>  <AMOUNT_CURRENT> (1,480)
33.1

$$$$
WAY-312194
csChFnd80/10111816222D

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 11 16  1  0  0  0  0
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M  END
>  <Mol_ID> (1,481)
1234

>  <Formula> (1,481)
C14H14ClN5O2

>  <MolWeight> (1,481)
319.74626

>  <PCAT_CMPD_ID> (1,481)
WAY-312194

>  <CNC_ID> (1,481)
359315934

>  <transfer_container_id> (1,481)
PTN000000065

>  <COMPOUND_NUMBER> (1,481)
WAY-312194

>  <BAR_CODE_NO> (1,481)
3916791

>  <LOCATION_CODE> (1,481)
PTNCS

>  <AMOUNT_CURRENT> (1,481)
33.6

$$$$
WAY-310753
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,482)
1235

>  <Formula> (1,482)
C21H28N6O4

>  <MolWeight> (1,482)
428.48482

>  <PCAT_CMPD_ID> (1,482)
WAY-310753

>  <CNC_ID> (1,482)
359314494

>  <transfer_container_id> (1,482)
PTN000000065

>  <COMPOUND_NUMBER> (1,482)
WAY-310753

>  <BAR_CODE_NO> (1,482)
3915021

>  <LOCATION_CODE> (1,482)
PTNCS

>  <AMOUNT_CURRENT> (1,482)
33.3

$$$$
WAY-310728
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,483)
1236

>  <Formula> (1,483)
C19H30N6O3

>  <MolWeight> (1,483)
390.4799

>  <PCAT_CMPD_ID> (1,483)
WAY-310728

>  <CNC_ID> (1,483)
359314469

>  <transfer_container_id> (1,483)
PTN000000065

>  <COMPOUND_NUMBER> (1,483)
WAY-310728

>  <BAR_CODE_NO> (1,483)
3914988

>  <LOCATION_CODE> (1,483)
PTNCS

>  <AMOUNT_CURRENT> (1,483)
33.7

$$$$
WAY-311026
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 22 25  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,484)
1237

>  <Formula> (1,484)
C20H25N5O2

>  <MolWeight> (1,484)
367.4448

>  <PCAT_CMPD_ID> (1,484)
WAY-311026

>  <CNC_ID> (1,484)
359314768

>  <transfer_container_id> (1,484)
PTN000000065

>  <COMPOUND_NUMBER> (1,484)
WAY-311026

>  <BAR_CODE_NO> (1,484)
3915360

>  <LOCATION_CODE> (1,484)
PTNCS

>  <AMOUNT_CURRENT> (1,484)
33

$$$$
WAY-312163
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  5  7  2  0  0  0  0
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M  END
>  <Mol_ID> (1,485)
1238

>  <Formula> (1,485)
C21H27N5O2

>  <MolWeight> (1,485)
381.47138

>  <PCAT_CMPD_ID> (1,485)
WAY-312163

>  <CNC_ID> (1,485)
359315903

>  <transfer_container_id> (1,485)
PTN000000065

>  <COMPOUND_NUMBER> (1,485)
WAY-312163

>  <BAR_CODE_NO> (1,485)
3916749

>  <LOCATION_CODE> (1,485)
PTNCS

>  <AMOUNT_CURRENT> (1,485)
33.7

$$$$
WAY-313150
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,486)
1239

>  <Formula> (1,486)
C25H22F3N5O

>  <MolWeight> (1,486)
465.4702896

>  <PCAT_CMPD_ID> (1,486)
WAY-313150

>  <CNC_ID> (1,486)
359328186

>  <transfer_container_id> (1,486)
PTN000000067

>  <COMPOUND_NUMBER> (1,486)
WAY-313150

>  <BAR_CODE_NO> (1,486)
3917953

>  <LOCATION_CODE> (1,486)
PTNCS

>  <AMOUNT_CURRENT> (1,486)
33.2

$$$$
WAY-312695
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,487)
1240

>  <Formula> (1,487)
C19H17F3N4O

>  <MolWeight> (1,487)
374.3596896

>  <PCAT_CMPD_ID> (1,487)
WAY-312695

>  <CNC_ID> (1,487)
359327732

>  <transfer_container_id> (1,487)
PTN000000067

>  <COMPOUND_NUMBER> (1,487)
WAY-312695

>  <BAR_CODE_NO> (1,487)
3917367

>  <LOCATION_CODE> (1,487)
PTNCS

>  <AMOUNT_CURRENT> (1,487)
33

$$$$
WAY-310852
csChFnd80/10111816222D

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 26 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,488)
1241

>  <Formula> (1,488)
C21H21F3N4O

>  <MolWeight> (1,488)
402.4128496

>  <PCAT_CMPD_ID> (1,488)
WAY-310852

>  <CNC_ID> (1,488)
359314594

>  <transfer_container_id> (1,488)
PTN000000065

>  <COMPOUND_NUMBER> (1,488)
WAY-310852

>  <BAR_CODE_NO> (1,488)
3915139

>  <LOCATION_CODE> (1,488)
PTNCS

>  <AMOUNT_CURRENT> (1,488)
33.2

$$$$
WAY-313210
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,489)
1242

>  <Formula> (1,489)
C23H16F3N5O3

>  <MolWeight> (1,489)
467.4000496

>  <PCAT_CMPD_ID> (1,489)
WAY-313210

>  <CNC_ID> (1,489)
359328246

>  <transfer_container_id> (1,489)
PTN000000067

>  <COMPOUND_NUMBER> (1,489)
WAY-313210

>  <BAR_CODE_NO> (1,489)
3918040

>  <LOCATION_CODE> (1,489)
PTNCS

>  <AMOUNT_CURRENT> (1,489)
33.1

$$$$
WAY-312983
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,490)
1243

>  <Formula> (1,490)
C20H18BrF3N4O2

>  <MolWeight> (1,490)
483.2817296

>  <PCAT_CMPD_ID> (1,490)
WAY-312983

>  <CNC_ID> (1,490)
359328020

>  <transfer_container_id> (1,490)
PTN000000067

>  <COMPOUND_NUMBER> (1,490)
WAY-312983

>  <BAR_CODE_NO> (1,490)
3917747

>  <LOCATION_CODE> (1,490)
PTNCS

>  <AMOUNT_CURRENT> (1,490)
33.2

$$$$
WAY-310546
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,491)
1244

>  <Formula> (1,491)
C17H11F3N4O2S

>  <MolWeight> (1,491)
392.3550496

>  <PCAT_CMPD_ID> (1,491)
WAY-310546

>  <CNC_ID> (1,491)
359314287

>  <transfer_container_id> (1,491)
PTN000000065

>  <COMPOUND_NUMBER> (1,491)
WAY-310546

>  <BAR_CODE_NO> (1,491)
3914777

>  <LOCATION_CODE> (1,491)
PTNCS

>  <AMOUNT_CURRENT> (1,491)
33.4

$$$$
WAY-312755
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 15  9  1  0  0  0  0
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 18 15  1  0  0  0  0
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M  END
>  <Mol_ID> (1,492)
1245

>  <Formula> (1,492)
C11H11BrN4O2

>  <MolWeight> (1,492)
311.13464

>  <PCAT_CMPD_ID> (1,492)
WAY-312755

>  <CNC_ID> (1,492)
359327792

>  <transfer_container_id> (1,492)
PTN000000067

>  <COMPOUND_NUMBER> (1,492)
WAY-312755

>  <BAR_CODE_NO> (1,492)
3917450

>  <LOCATION_CODE> (1,492)
PTNCS

>  <AMOUNT_CURRENT> (1,492)
33.5

$$$$
WAY-230563
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,493)
1246

>  <Formula> (1,493)
C17H12N2O2S

>  <MolWeight> (1,493)
308.35438

>  <PCAT_CMPD_ID> (1,493)
WAY-230563

>  <CNC_ID> (1,493)
359313893

>  <transfer_container_id> (1,493)
PTN000000065

>  <COMPOUND_NUMBER> (1,493)
WAY-230563

>  <BAR_CODE_NO> (1,493)
3915729

>  <LOCATION_CODE> (1,493)
PTNCS

>  <AMOUNT_CURRENT> (1,493)
33.1

$$$$
WAY-311340
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,494)
1247

>  <Formula> (1,494)
C20H21ClN4O2

>  <MolWeight> (1,494)
384.85934

>  <PCAT_CMPD_ID> (1,494)
WAY-311340

>  <CNC_ID> (1,494)
359315081

>  <transfer_container_id> (1,494)
PTN000000065

>  <COMPOUND_NUMBER> (1,494)
WAY-311340

>  <BAR_CODE_NO> (1,494)
3915715

>  <LOCATION_CODE> (1,494)
PTNCS

>  <AMOUNT_CURRENT> (1,494)
30

$$$$
WAY-235142
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,495)
1248

>  <Formula> (1,495)
C17H18N2O

>  <MolWeight> (1,495)
266.33762

>  <PCAT_CMPD_ID> (1,495)
WAY-235142

>  <CNC_ID> (1,495)
359313934

>  <transfer_container_id> (1,495)
PTN000000065

>  <COMPOUND_NUMBER> (1,495)
WAY-235142

>  <BAR_CODE_NO> (1,495)
3916057

>  <LOCATION_CODE> (1,495)
PTNCS

>  <AMOUNT_CURRENT> (1,495)
33.8

$$$$
WAY-117311
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,496)
1249

>  <Formula> (1,496)
C23H24N4O2S

>  <MolWeight> (1,496)
420.52726

>  <PCAT_CMPD_ID> (1,496)
WAY-117311

>  <CNC_ID> (1,496)
359326825

>  <transfer_container_id> (1,496)
PTN000000067

>  <COMPOUND_NUMBER> (1,496)
WAY-117311

>  <BAR_CODE_NO> (1,496)
3917728

>  <LOCATION_CODE> (1,496)
PTNCS

>  <AMOUNT_CURRENT> (1,496)
33.1

$$$$
WAY-345109
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 26 24  2  0  0  0  0
  6  5  2  0  0  0  0
 13 12  1  0  0  0  0
 26 25  1  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,497)
1250

>  <Formula> (1,497)
C18H12F2N4OS

>  <MolWeight> (1,497)
370.3758864

>  <PCAT_CMPD_ID> (1,497)
WAY-345109

>  <CNC_ID> (1,497)
359320417

>  <transfer_container_id> (1,497)
PTN000000065

>  <COMPOUND_NUMBER> (1,497)
WAY-345109

>  <BAR_CODE_NO> (1,497)
2555386

>  <LOCATION_CODE> (1,497)
PTNCS

>  <AMOUNT_CURRENT> (1,497)
32.6

$$$$
WAY-311541
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 22 24  2  0  0  0  0
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 19 20  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,498)
1251

>  <Formula> (1,498)
C17H15Cl2N3O2

>  <MolWeight> (1,498)
364.2259

>  <PCAT_CMPD_ID> (1,498)
WAY-311541

>  <CNC_ID> (1,498)
359315282

>  <transfer_container_id> (1,498)
PTN000000065

>  <COMPOUND_NUMBER> (1,498)
WAY-311541

>  <BAR_CODE_NO> (1,498)
3915945

>  <LOCATION_CODE> (1,498)
PTNCS

>  <AMOUNT_CURRENT> (1,498)
33

$$$$
WAY-311747
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  5  7  2  0  0  0  0
  9 12  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,499)
1252

>  <Formula> (1,499)
C16H21N3O2

>  <MolWeight> (1,499)
287.35684

>  <PCAT_CMPD_ID> (1,499)
WAY-311747

>  <CNC_ID> (1,499)
359315488

>  <transfer_container_id> (1,499)
PTN000000065

>  <COMPOUND_NUMBER> (1,499)
WAY-311747

>  <BAR_CODE_NO> (1,499)
3916233

>  <LOCATION_CODE> (1,499)
PTNCS

>  <AMOUNT_CURRENT> (1,499)
33.9

$$$$
WAY-310421-A
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  5  7  2  0  0  0  0
  6  9  2  0  0  0  0
 14 15  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,500)
1253

>  <Formula> (1,500)
C19H26N4O

>  <MolWeight> (1,500)
326.43594

>  <PCAT_CMPD_ID> (1,500)
WAY-310421-A

>  <CNC_ID> (1,500)
359314162

>  <transfer_container_id> (1,500)
PTN000000065

>  <COMPOUND_NUMBER> (1,500)
WAY-310421-A

>  <BAR_CODE_NO> (1,500)
3914635

>  <LOCATION_CODE> (1,500)
PTNCS

>  <AMOUNT_CURRENT> (1,500)
33.6

$$$$
CL-421166
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 16 21  1  0  0  0  0
 20 22  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (1,501)
1254

>  <Formula> (1,501)
C24H23N5

>  <MolWeight> (1,501)
381.47292

>  <PCAT_CMPD_ID> (1,501)
CL-421166

>  <CNC_ID> (1,501)
359326751

>  <transfer_container_id> (1,501)
PTN000000067

>  <COMPOUND_NUMBER> (1,501)
CL-421166

>  <BAR_CODE_NO> (1,501)
3917557

>  <LOCATION_CODE> (1,501)
PTNCS

>  <AMOUNT_CURRENT> (1,501)
33.4

$$$$
CL-406456
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
  9 11  1  0  0  0  0
 14 18  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,502)
1255

>  <Formula> (1,502)
C19H21N5O

>  <MolWeight> (1,502)
335.40294

>  <PCAT_CMPD_ID> (1,502)
CL-406456

>  <CNC_ID> (1,502)
359326723

>  <transfer_container_id> (1,502)
PTN000000067

>  <COMPOUND_NUMBER> (1,502)
CL-406456

>  <BAR_CODE_NO> (1,502)
3917502

>  <LOCATION_CODE> (1,502)
PTNCS

>  <AMOUNT_CURRENT> (1,502)
33.7

$$$$
WAY-311374
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 23  1  0  0  0  0
 13  9  2  0  0  0  0
 14 15  2  0  0  0  0
 15 13  1  0  0  0  0
 16 10  1  0  0  0  0
 17  7  1  0  0  0  0
 18  7  1  0  0  0  0
 19  5  2  0  0  0  0
 20 14  1  0  0  0  0
 21  8  2  0  0  0  0
 22 17  1  0  0  0  0
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 25 20  1  0  0  0  0
 26 19  1  0  0  0  0
 27 26  2  0  0  0  0
  4  8  1  0  0  0  0
 22 12  1  0  0  0  0
 27 21  1  0  0  0  0
 11 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,503)
1256

>  <Formula> (1,503)
C20H23N5O2

>  <MolWeight> (1,503)
365.42892

>  <PCAT_CMPD_ID> (1,503)
WAY-311374

>  <CNC_ID> (1,503)
359315115

>  <transfer_container_id> (1,503)
PTN000000065

>  <COMPOUND_NUMBER> (1,503)
WAY-311374

>  <BAR_CODE_NO> (1,503)
3915753

>  <LOCATION_CODE> (1,503)
PTNCS

>  <AMOUNT_CURRENT> (1,503)
33.4

$$$$
WAY-311745
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 14 16  1  0  0  0  0
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 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
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 22 23  1  0  0  0  0
  5  7  2  0  0  0  0
  9 12  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,504)
1257

>  <Formula> (1,504)
C18H19N3OS

>  <MolWeight> (1,504)
325.42796

>  <PCAT_CMPD_ID> (1,504)
WAY-311745

>  <CNC_ID> (1,504)
359315486

>  <transfer_container_id> (1,504)
PTN000000065

>  <COMPOUND_NUMBER> (1,504)
WAY-311745

>  <BAR_CODE_NO> (1,504)
3916231

>  <LOCATION_CODE> (1,504)
PTNCS

>  <AMOUNT_CURRENT> (1,504)
33.5

$$$$
WAY-310288
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 14  2  0  0  0  0
 12 15  1  0  0  0  0
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 17 19  1  0  0  0  0
  7 10  1  0  0  0  0
  8 12  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,505)
1258

>  <Formula> (1,505)
C16H17N3

>  <MolWeight> (1,505)
251.32628

>  <PCAT_CMPD_ID> (1,505)
WAY-310288

>  <CNC_ID> (1,505)
359314029

>  <transfer_container_id> (1,505)
PTN000000065

>  <COMPOUND_NUMBER> (1,505)
WAY-310288

>  <BAR_CODE_NO> (1,505)
3914483

>  <LOCATION_CODE> (1,505)
PTNCS

>  <AMOUNT_CURRENT> (1,505)
33.6

$$$$
WAY-312136-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  7 12  2  0  0  0  0
  9 13  2  0  0  0  0
 15 17  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,506)
1259

>  <Formula> (1,506)
C19H20N4O2

>  <MolWeight> (1,506)
336.3877

>  <PCAT_CMPD_ID> (1,506)
WAY-312136-A

>  <CNC_ID> (1,506)
359315876

>  <transfer_container_id> (1,506)
PTN000000065

>  <COMPOUND_NUMBER> (1,506)
WAY-312136-A

>  <BAR_CODE_NO> (1,506)
3916720

>  <LOCATION_CODE> (1,506)
PTNCS

>  <AMOUNT_CURRENT> (1,506)
33.9

$$$$
WAY-311903
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  9 10  2  0  0  0  0
 12 16  2  0  0  0  0
 14 18  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,507)
1260

>  <Formula> (1,507)
C19H19N3O

>  <MolWeight> (1,507)
305.37366

>  <PCAT_CMPD_ID> (1,507)
WAY-311903

>  <CNC_ID> (1,507)
359315644

>  <transfer_container_id> (1,507)
PTN000000065

>  <COMPOUND_NUMBER> (1,507)
WAY-311903

>  <BAR_CODE_NO> (1,507)
3916430

>  <LOCATION_CODE> (1,507)
PTNCS

>  <AMOUNT_CURRENT> (1,507)
33.2

$$$$
WAY-246857
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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 16 20  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,508)
1261

>  <Formula> (1,508)
C18H18N4O4S2

>  <MolWeight> (1,508)
418.48992

>  <PCAT_CMPD_ID> (1,508)
WAY-246857

>  <CNC_ID> (1,508)
359326922

>  <transfer_container_id> (1,508)
PTN000000067

>  <COMPOUND_NUMBER> (1,508)
WAY-246857

>  <BAR_CODE_NO> (1,508)
3918030

>  <LOCATION_CODE> (1,508)
PTNCS

>  <AMOUNT_CURRENT> (1,508)
33.3

$$$$
WAY-312001
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,509)
1262

>  <Formula> (1,509)
C22H22F3N5O4

>  <MolWeight> (1,509)
477.4363896

>  <PCAT_CMPD_ID> (1,509)
WAY-312001

>  <CNC_ID> (1,509)
359315742

>  <transfer_container_id> (1,509)
PTN000000065

>  <COMPOUND_NUMBER> (1,509)
WAY-312001

>  <BAR_CODE_NO> (1,509)
3916553

>  <LOCATION_CODE> (1,509)
PTNCS

>  <AMOUNT_CURRENT> (1,509)
33.4

$$$$
WAY-237190
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 12 15  2  0  0  0  0
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 10 11  1  0  0  0  0
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M  END
>  <Mol_ID> (1,510)
1263

>  <Formula> (1,510)
C13H13N5

>  <MolWeight> (1,510)
239.27582

>  <PCAT_CMPD_ID> (1,510)
WAY-237190

>  <CNC_ID> (1,510)
359313947

>  <transfer_container_id> (1,510)
PTN000000065

>  <COMPOUND_NUMBER> (1,510)
WAY-237190

>  <BAR_CODE_NO> (1,510)
3916969

>  <LOCATION_CODE> (1,510)
PTNCS

>  <AMOUNT_CURRENT> (1,510)
33.1

$$$$
WAY-229387
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,511)
1264

>  <Formula> (1,511)
C14H15N5

>  <MolWeight> (1,511)
253.3024

>  <PCAT_CMPD_ID> (1,511)
WAY-229387

>  <CNC_ID> (1,511)
359313883

>  <transfer_container_id> (1,511)
PTN000000065

>  <COMPOUND_NUMBER> (1,511)
WAY-229387

>  <BAR_CODE_NO> (1,511)
3916974

>  <LOCATION_CODE> (1,511)
PTNCS

>  <AMOUNT_CURRENT> (1,511)
33.7

$$$$
WAY-312673
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  1  4  2  0  0  0  0
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 12 15  1  0  0  0  0
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  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,512)
1265

>  <Formula> (1,512)
C12H10FN5

>  <MolWeight> (1,512)
243.2397032

>  <PCAT_CMPD_ID> (1,512)
WAY-312673

>  <CNC_ID> (1,512)
359327710

>  <transfer_container_id> (1,512)
PTN000000067

>  <COMPOUND_NUMBER> (1,512)
WAY-312673

>  <BAR_CODE_NO> (1,512)
3917335

>  <LOCATION_CODE> (1,512)
PTNCS

>  <AMOUNT_CURRENT> (1,512)
33.6

$$$$
WAY-232364
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
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 17 18  1  0  0  0  0
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 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,513)
1266

>  <Formula> (1,513)
C14H13N5O2

>  <MolWeight> (1,513)
283.28532

>  <PCAT_CMPD_ID> (1,513)
WAY-232364

>  <CNC_ID> (1,513)
359313905

>  <transfer_container_id> (1,513)
PTN000000065

>  <COMPOUND_NUMBER> (1,513)
WAY-232364

>  <BAR_CODE_NO> (1,513)
3916967

>  <LOCATION_CODE> (1,513)
PTNCS

>  <AMOUNT_CURRENT> (1,513)
33.2

$$$$
WAY-232363
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  7 11  2  0  0  0  0
  8  9  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,514)
1267

>  <Formula> (1,514)
C13H13N5

>  <MolWeight> (1,514)
239.27582

>  <PCAT_CMPD_ID> (1,514)
WAY-232363

>  <CNC_ID> (1,514)
359326892

>  <transfer_container_id> (1,514)
PTN000000067

>  <COMPOUND_NUMBER> (1,514)
WAY-232363

>  <BAR_CODE_NO> (1,514)
3918244

>  <LOCATION_CODE> (1,514)
PTNCS

>  <AMOUNT_CURRENT> (1,514)
33.2

$$$$
WAY-232367
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,515)
1268

>  <Formula> (1,515)
C14H15N5

>  <MolWeight> (1,515)
253.3024

>  <PCAT_CMPD_ID> (1,515)
WAY-232367

>  <CNC_ID> (1,515)
359313906

>  <transfer_container_id> (1,515)
PTN000000065

>  <COMPOUND_NUMBER> (1,515)
WAY-232367

>  <BAR_CODE_NO> (1,515)
3916973

>  <LOCATION_CODE> (1,515)
PTNCS

>  <AMOUNT_CURRENT> (1,515)
33.8

$$$$
WAY-312484
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  8  9  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,516)
1269

>  <Formula> (1,516)
C13H13N5O

>  <MolWeight> (1,516)
255.27522

>  <PCAT_CMPD_ID> (1,516)
WAY-312484

>  <CNC_ID> (1,516)
359316224

>  <transfer_container_id> (1,516)
PTN000000065

>  <COMPOUND_NUMBER> (1,516)
WAY-312484

>  <BAR_CODE_NO> (1,516)
3917125

>  <LOCATION_CODE> (1,516)
PTNCS

>  <AMOUNT_CURRENT> (1,516)
33.7

$$$$
WAY-312344
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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M  END
>  <Mol_ID> (1,517)
1270

>  <Formula> (1,517)
C14H15N5

>  <MolWeight> (1,517)
253.3024

>  <PCAT_CMPD_ID> (1,517)
WAY-312344

>  <CNC_ID> (1,517)
359316084

>  <transfer_container_id> (1,517)
PTN000000065

>  <COMPOUND_NUMBER> (1,517)
WAY-312344

>  <BAR_CODE_NO> (1,517)
3916970

>  <LOCATION_CODE> (1,517)
PTNCS

>  <AMOUNT_CURRENT> (1,517)
33.4

$$$$
CL-426948
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (1,518)
1271

>  <Formula> (1,518)
C20H14F3N5O

>  <MolWeight> (1,518)
397.3532696

>  <PCAT_CMPD_ID> (1,518)
CL-426948

>  <CNC_ID> (1,518)
359313634

>  <transfer_container_id> (1,518)
PTN000000065

>  <COMPOUND_NUMBER> (1,518)
CL-426948

>  <BAR_CODE_NO> (1,518)
3915432

>  <LOCATION_CODE> (1,518)
PTNCS

>  <AMOUNT_CURRENT> (1,518)
33.7

$$$$
WAY-310461
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,519)
1272

>  <Formula> (1,519)
C13H10N2O2

>  <MolWeight> (1,519)
226.2307

>  <PCAT_CMPD_ID> (1,519)
WAY-310461

>  <CNC_ID> (1,519)
359314202

>  <transfer_container_id> (1,519)
PTN000000065

>  <COMPOUND_NUMBER> (1,519)
WAY-310461

>  <BAR_CODE_NO> (1,519)
3914682

>  <LOCATION_CODE> (1,519)
PTNCS

>  <AMOUNT_CURRENT> (1,519)
33

$$$$
WAY-312539
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,520)
1273

>  <Formula> (1,520)
C13H11N3O

>  <MolWeight> (1,520)
225.24594

>  <PCAT_CMPD_ID> (1,520)
WAY-312539

>  <CNC_ID> (1,520)
359316278

>  <transfer_container_id> (1,520)
PTN000000065

>  <COMPOUND_NUMBER> (1,520)
WAY-312539

>  <BAR_CODE_NO> (1,520)
3917192

>  <LOCATION_CODE> (1,520)
PTNCS

>  <AMOUNT_CURRENT> (1,520)
33.2

$$$$
WAY-313194
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,521)
1274

>  <Formula> (1,521)
C16H23N5O4

>  <MolWeight> (1,521)
349.38492

>  <PCAT_CMPD_ID> (1,521)
WAY-313194

>  <CNC_ID> (1,521)
359328230

>  <transfer_container_id> (1,521)
PTN000000067

>  <COMPOUND_NUMBER> (1,521)
WAY-313194

>  <BAR_CODE_NO> (1,521)
3918010

>  <LOCATION_CODE> (1,521)
PTNCS

>  <AMOUNT_CURRENT> (1,521)
33.3

$$$$
WAY-312982
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,522)
1275

>  <Formula> (1,522)
C14H19N5O5

>  <MolWeight> (1,522)
337.33116

>  <PCAT_CMPD_ID> (1,522)
WAY-312982

>  <CNC_ID> (1,522)
359328019

>  <transfer_container_id> (1,522)
PTN000000067

>  <COMPOUND_NUMBER> (1,522)
WAY-312982

>  <BAR_CODE_NO> (1,522)
3917746

>  <LOCATION_CODE> (1,522)
PTNCS

>  <AMOUNT_CURRENT> (1,522)
33.1

$$$$
WAY-344600
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,523)
1276

>  <Formula> (1,523)
C18H14N2O4S

>  <MolWeight> (1,523)
354.37976

>  <PCAT_CMPD_ID> (1,523)
WAY-344600

>  <CNC_ID> (1,523)
359319918

>  <transfer_container_id> (1,523)
PTN000000065

>  <COMPOUND_NUMBER> (1,523)
WAY-344600

>  <BAR_CODE_NO> (1,523)
2554829

>  <LOCATION_CODE> (1,523)
PTNCS

>  <AMOUNT_CURRENT> (1,523)
26.9

$$$$
WAY-344904
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,524)
1277

>  <Formula> (1,524)
C18H19N3O3S

>  <MolWeight> (1,524)
357.42676

>  <PCAT_CMPD_ID> (1,524)
WAY-344904

>  <CNC_ID> (1,524)
359320215

>  <transfer_container_id> (1,524)
PTN000000065

>  <COMPOUND_NUMBER> (1,524)
WAY-344904

>  <BAR_CODE_NO> (1,524)
2555136

>  <LOCATION_CODE> (1,524)
PTNCS

>  <AMOUNT_CURRENT> (1,524)
33

$$$$
WAY-310467
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,525)
1278

>  <Formula> (1,525)
C20H20ClN5OS

>  <MolWeight> (1,525)
413.9237

>  <PCAT_CMPD_ID> (1,525)
WAY-310467

>  <CNC_ID> (1,525)
359314208

>  <transfer_container_id> (1,525)
PTN000000065

>  <COMPOUND_NUMBER> (1,525)
WAY-310467

>  <BAR_CODE_NO> (1,525)
3914688

>  <LOCATION_CODE> (1,525)
PTNCS

>  <AMOUNT_CURRENT> (1,525)
33.3

$$$$
WAY-311384
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,526)
1279

>  <Formula> (1,526)
C22H17F3N4O5

>  <MolWeight> (1,526)
474.3893896

>  <PCAT_CMPD_ID> (1,526)
WAY-311384

>  <CNC_ID> (1,526)
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>  <transfer_container_id> (1,526)
PTN000000065

>  <COMPOUND_NUMBER> (1,526)
WAY-311384

>  <BAR_CODE_NO> (1,526)
3915763

>  <LOCATION_CODE> (1,526)
PTNCS

>  <AMOUNT_CURRENT> (1,526)
33.8

$$$$
WAY-312367
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,527)
1280

>  <Formula> (1,527)
C23H12N2O6

>  <MolWeight> (1,527)
412.35118

>  <PCAT_CMPD_ID> (1,527)
WAY-312367

>  <CNC_ID> (1,527)
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>  <transfer_container_id> (1,527)
PTN000000065

>  <COMPOUND_NUMBER> (1,527)
WAY-312367

>  <BAR_CODE_NO> (1,527)
3916996

>  <LOCATION_CODE> (1,527)
PTNCS

>  <AMOUNT_CURRENT> (1,527)
33.3

$$$$
WAY-245204
csChFnd80/10111816222D

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  5  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,528)
1281

>  <Formula> (1,528)
C15H15NO4S

>  <MolWeight> (1,528)
305.3489

>  <PCAT_CMPD_ID> (1,528)
WAY-245204

>  <CNC_ID> (1,528)
359314005

>  <transfer_container_id> (1,528)
PTN000000065

>  <COMPOUND_NUMBER> (1,528)
WAY-245204

>  <BAR_CODE_NO> (1,528)
3915470

>  <LOCATION_CODE> (1,528)
PTNCS

>  <AMOUNT_CURRENT> (1,528)
33.8

$$$$
WAY-226745
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  9 13  1  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,529)
1282

>  <Formula> (1,529)
C13H12N4O

>  <MolWeight> (1,529)
240.26058

>  <PCAT_CMPD_ID> (1,529)
WAY-226745

>  <CNC_ID> (1,529)
359313861

>  <transfer_container_id> (1,529)
PTN000000065

>  <COMPOUND_NUMBER> (1,529)
WAY-226745

>  <BAR_CODE_NO> (1,529)
3914983

>  <LOCATION_CODE> (1,529)
PTNCS

>  <AMOUNT_CURRENT> (1,529)
33.7

$$$$
WAY-311693
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,530)
1283

>  <Formula> (1,530)
C22H20N2O5

>  <MolWeight> (1,530)
392.4046

>  <PCAT_CMPD_ID> (1,530)
WAY-311693

>  <CNC_ID> (1,530)
359315434

>  <transfer_container_id> (1,530)
PTN000000065

>  <COMPOUND_NUMBER> (1,530)
WAY-311693

>  <BAR_CODE_NO> (1,530)
3916158

>  <LOCATION_CODE> (1,530)
PTNCS

>  <AMOUNT_CURRENT> (1,530)
33.6

$$$$
WAY-310402
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,531)
1284

>  <Formula> (1,531)
C10H9N3S2

>  <MolWeight> (1,531)
235.32856

>  <PCAT_CMPD_ID> (1,531)
WAY-310402

>  <CNC_ID> (1,531)
359314143

>  <transfer_container_id> (1,531)
PTN000000065

>  <COMPOUND_NUMBER> (1,531)
WAY-310402

>  <BAR_CODE_NO> (1,531)
3914616

>  <LOCATION_CODE> (1,531)
PTNCS

>  <AMOUNT_CURRENT> (1,531)
33.4

$$$$
WAY-311276
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,532)
1285

>  <Formula> (1,532)
C12H13N3S

>  <MolWeight> (1,532)
231.31672

>  <PCAT_CMPD_ID> (1,532)
WAY-311276

>  <CNC_ID> (1,532)
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>  <transfer_container_id> (1,532)
PTN000000065

>  <COMPOUND_NUMBER> (1,532)
WAY-311276

>  <BAR_CODE_NO> (1,532)
3915646

>  <LOCATION_CODE> (1,532)
PTNCS

>  <AMOUNT_CURRENT> (1,532)
33.4

$$$$
CL-406828
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,533)
1286

>  <Formula> (1,533)
C19H21N5S

>  <MolWeight> (1,533)
351.46854

>  <PCAT_CMPD_ID> (1,533)
CL-406828

>  <CNC_ID> (1,533)
359326726

>  <transfer_container_id> (1,533)
PTN000000067

>  <COMPOUND_NUMBER> (1,533)
CL-406828

>  <BAR_CODE_NO> (1,533)
3917586

>  <LOCATION_CODE> (1,533)
PTNCS

>  <AMOUNT_CURRENT> (1,533)
33.3

$$$$
CL-319477
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,534)
1287

>  <Formula> (1,534)
C16H15N3OS

>  <MolWeight> (1,534)
297.3748

>  <PCAT_CMPD_ID> (1,534)
CL-319477

>  <CNC_ID> (1,534)
359313574

>  <transfer_container_id> (1,534)
PTN000000065

>  <COMPOUND_NUMBER> (1,534)
CL-319477

>  <BAR_CODE_NO> (1,534)
3914964

>  <LOCATION_CODE> (1,534)
PTNCS

>  <AMOUNT_CURRENT> (1,534)
33.6

$$$$
CL-417925
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,535)
1288

>  <Formula> (1,535)
C16H17N3S

>  <MolWeight> (1,535)
283.39128

>  <PCAT_CMPD_ID> (1,535)
CL-417925

>  <CNC_ID> (1,535)
359313619

>  <transfer_container_id> (1,535)
PTN000000065

>  <COMPOUND_NUMBER> (1,535)
CL-417925

>  <BAR_CODE_NO> (1,535)
3916535

>  <LOCATION_CODE> (1,535)
PTNCS

>  <AMOUNT_CURRENT> (1,535)
33.7

$$$$
WAY-310942
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,536)
1289

>  <Formula> (1,536)
C12H13N3O2S

>  <MolWeight> (1,536)
263.31552

>  <PCAT_CMPD_ID> (1,536)
WAY-310942

>  <CNC_ID> (1,536)
359314684

>  <transfer_container_id> (1,536)
PTN000000065

>  <COMPOUND_NUMBER> (1,536)
WAY-310942

>  <BAR_CODE_NO> (1,536)
3915249

>  <LOCATION_CODE> (1,536)
PTNCS

>  <AMOUNT_CURRENT> (1,536)
33.6

$$$$
WAY-344727
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,537)
1290

>  <Formula> (1,537)
C17H20N4O2S2

>  <MolWeight> (1,537)
376.4963

>  <PCAT_CMPD_ID> (1,537)
WAY-344727

>  <CNC_ID> (1,537)
359320039

>  <transfer_container_id> (1,537)
PTN000000065

>  <COMPOUND_NUMBER> (1,537)
WAY-344727

>  <BAR_CODE_NO> (1,537)
2554964

>  <LOCATION_CODE> (1,537)
PTNCS

>  <AMOUNT_CURRENT> (1,537)
32.4

$$$$
CL-403013
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,538)
1291

>  <Formula> (1,538)
C15H16N4S

>  <MolWeight> (1,538)
284.37934

>  <PCAT_CMPD_ID> (1,538)
CL-403013

>  <CNC_ID> (1,538)
359313590

>  <transfer_container_id> (1,538)
PTN000000065

>  <COMPOUND_NUMBER> (1,538)
CL-403013

>  <BAR_CODE_NO> (1,538)
3916254

>  <LOCATION_CODE> (1,538)
PTNCS

>  <AMOUNT_CURRENT> (1,538)
33.1

$$$$
GI-560189
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
    0.6688   -0.8132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 11 14  1  0  0  0  0
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M  END
>  <Mol_ID> (1,539)
1292

>  <Formula> (1,539)
C14H13N3S

>  <MolWeight> (1,539)
255.33812

>  <PCAT_CMPD_ID> (1,539)
GI-560189

>  <CNC_ID> (1,539)
359326787

>  <transfer_container_id> (1,539)
PTN000000067

>  <COMPOUND_NUMBER> (1,539)
GI-560189

>  <BAR_CODE_NO> (1,539)
3918045

>  <LOCATION_CODE> (1,539)
PTNCS

>  <AMOUNT_CURRENT> (1,539)
33.6

$$$$
WAY-311753-A
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
   -0.3724   -0.4862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 15  1  0  0  0  0
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  5  7  1  0  0  0  0
 10 13  1  0  0  0  0
 12 15  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,540)
1293

>  <Formula> (1,540)
C16H15N3OS

>  <MolWeight> (1,540)
297.3748

>  <PCAT_CMPD_ID> (1,540)
WAY-311753-A

>  <CNC_ID> (1,540)
359315494

>  <transfer_container_id> (1,540)
PTN000000065

>  <COMPOUND_NUMBER> (1,540)
WAY-311753-A

>  <BAR_CODE_NO> (1,540)
3916239

>  <LOCATION_CODE> (1,540)
PTNCS

>  <AMOUNT_CURRENT> (1,540)
33.4

$$$$
WAY-217268
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  4  1  0  0  0  0
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 18  6  1  0  0  0  0
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 20  8  1  0  0  0  0
 21 16  1  0  0  0  0
 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
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  4  9  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,541)
1294

>  <Formula> (1,541)
C16H17N3O2S2

>  <MolWeight> (1,541)
347.45508

>  <PCAT_CMPD_ID> (1,541)
WAY-217268

>  <CNC_ID> (1,541)
359326851

>  <transfer_container_id> (1,541)
PTN000000067

>  <COMPOUND_NUMBER> (1,541)
WAY-217268

>  <BAR_CODE_NO> (1,541)
3917517

>  <LOCATION_CODE> (1,541)
PTNCS

>  <AMOUNT_CURRENT> (1,541)
33.5

$$$$
WAY-310587-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 17 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,542)
1295

>  <Formula> (1,542)
C15H13ClN4OS2

>  <MolWeight> (1,542)
364.87292

>  <PCAT_CMPD_ID> (1,542)
WAY-310587-A

>  <CNC_ID> (1,542)
359314328

>  <transfer_container_id> (1,542)
PTN000000065

>  <COMPOUND_NUMBER> (1,542)
WAY-310587-A

>  <BAR_CODE_NO> (1,542)
3914821

>  <LOCATION_CODE> (1,542)
PTNCS

>  <AMOUNT_CURRENT> (1,542)
33.4

$$$$
WAY-310586-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,543)
1296

>  <Formula> (1,543)
C16H16N4OS2

>  <MolWeight> (1,543)
344.45444

>  <PCAT_CMPD_ID> (1,543)
WAY-310586-A

>  <CNC_ID> (1,543)
359314327

>  <transfer_container_id> (1,543)
PTN000000065

>  <COMPOUND_NUMBER> (1,543)
WAY-310586-A

>  <BAR_CODE_NO> (1,543)
3914820

>  <LOCATION_CODE> (1,543)
PTNCS

>  <AMOUNT_CURRENT> (1,543)
33.8

$$$$
WAY-313237
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 18 22  1  0  0  0  0
 20 23  2  0  0  0  0
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 24 25  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,544)
1297

>  <Formula> (1,544)
C17H18N4O2S2

>  <MolWeight> (1,544)
374.48042

>  <PCAT_CMPD_ID> (1,544)
WAY-313237

>  <CNC_ID> (1,544)
359328273

>  <transfer_container_id> (1,544)
PTN000000067

>  <COMPOUND_NUMBER> (1,544)
WAY-313237

>  <BAR_CODE_NO> (1,544)
3918081

>  <LOCATION_CODE> (1,544)
PTNCS

>  <AMOUNT_CURRENT> (1,544)
33.6

$$$$
WAY-344287
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  3  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  2  0  0  0  0
 14  6  1  0  0  0  0
 15  5  2  0  0  0  0
 16 12  2  0  0  0  0
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 22  9  1  0  0  0  0
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 11 12  1  0  0  0  0
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  6  9  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,545)
1298

>  <Formula> (1,545)
C20H16N4O3S

>  <MolWeight> (1,545)
392.43104

>  <PCAT_CMPD_ID> (1,545)
WAY-344287

>  <CNC_ID> (1,545)
359319623

>  <transfer_container_id> (1,545)
PTN000000065

>  <COMPOUND_NUMBER> (1,545)
WAY-344287

>  <BAR_CODE_NO> (1,545)
2554490

>  <LOCATION_CODE> (1,545)
PTNCS

>  <AMOUNT_CURRENT> (1,545)
32.5

$$$$
WAY-227614
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  2  1  0  0  0  0
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 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
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 19 18  1  0  0  0  0
 21 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,546)
1299

>  <Formula> (1,546)
C17H16FNO2

>  <MolWeight> (1,546)
285.3128432

>  <PCAT_CMPD_ID> (1,546)
WAY-227614

>  <CNC_ID> (1,546)
359313869

>  <transfer_container_id> (1,546)
PTN000000065

>  <COMPOUND_NUMBER> (1,546)
WAY-227614

>  <BAR_CODE_NO> (1,546)
3914670

>  <LOCATION_CODE> (1,546)
PTNCS

>  <AMOUNT_CURRENT> (1,546)
33.8

$$$$
WAY-311156
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  9 10  2  0  0  0  0
 16 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,547)
1300

>  <Formula> (1,547)
C16H22N2O3

>  <MolWeight> (1,547)
290.35748

>  <PCAT_CMPD_ID> (1,547)
WAY-311156

>  <CNC_ID> (1,547)
359314897

>  <transfer_container_id> (1,547)
PTN000000065

>  <COMPOUND_NUMBER> (1,547)
WAY-311156

>  <BAR_CODE_NO> (1,547)
3915515

>  <LOCATION_CODE> (1,547)
PTNCS

>  <AMOUNT_CURRENT> (1,547)
33.6

$$$$
WAY-114273
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  3  4  2  0  0  0  0
 13  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,548)
1301

>  <Formula> (1,548)
C17H24N2O

>  <MolWeight> (1,548)
272.38526

>  <PCAT_CMPD_ID> (1,548)
WAY-114273

>  <CNC_ID> (1,548)
359313696

>  <transfer_container_id> (1,548)
PTN000000065

>  <COMPOUND_NUMBER> (1,548)
WAY-114273

>  <BAR_CODE_NO> (1,548)
3916694

>  <LOCATION_CODE> (1,548)
PTNCS

>  <AMOUNT_CURRENT> (1,548)
33.2

$$$$
GI-523734
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,549)
1302

>  <Formula> (1,549)
C11H13N3OS

>  <MolWeight> (1,549)
235.30542

>  <PCAT_CMPD_ID> (1,549)
GI-523734

>  <CNC_ID> (1,549)
359313652

>  <transfer_container_id> (1,549)
PTN000000065

>  <COMPOUND_NUMBER> (1,549)
GI-523734

>  <BAR_CODE_NO> (1,549)
3916761

>  <LOCATION_CODE> (1,549)
PTNCS

>  <AMOUNT_CURRENT> (1,549)
33.2

$$$$
WAY-310786-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
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 17 18  1  0  0  0  0
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 14 15  2  0  0  0  0
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 16 17  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,550)
1303

>  <Formula> (1,550)
C16H14N2O2S

>  <MolWeight> (1,550)
298.35956

>  <PCAT_CMPD_ID> (1,550)
WAY-310786-A

>  <CNC_ID> (1,550)
359314527

>  <transfer_container_id> (1,550)
PTN000000065

>  <COMPOUND_NUMBER> (1,550)
WAY-310786-A

>  <BAR_CODE_NO> (1,550)
3915059

>  <LOCATION_CODE> (1,550)
PTNCS

>  <AMOUNT_CURRENT> (1,550)
33.5

$$$$
WAY-311449-A
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 16 12  1  0  0  0  0
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 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,551)
1304

>  <Formula> (1,551)
C16H15N3O3S2

>  <MolWeight> (1,551)
361.4386

>  <PCAT_CMPD_ID> (1,551)
WAY-311449-A

>  <CNC_ID> (1,551)
359315190

>  <transfer_container_id> (1,551)
PTN000000065

>  <COMPOUND_NUMBER> (1,551)
WAY-311449-A

>  <BAR_CODE_NO> (1,551)
3915836

>  <LOCATION_CODE> (1,551)
PTNCS

>  <AMOUNT_CURRENT> (1,551)
33.1

$$$$
WAY-311045
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 23 24  1  0  0  0  0
  5  7  2  0  0  0  0
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,552)
1305

>  <Formula> (1,552)
C16H17ClN4O2S

>  <MolWeight> (1,552)
364.84978

>  <PCAT_CMPD_ID> (1,552)
WAY-311045

>  <CNC_ID> (1,552)
359314787

>  <transfer_container_id> (1,552)
PTN000000065

>  <COMPOUND_NUMBER> (1,552)
WAY-311045

>  <BAR_CODE_NO> (1,552)
3915384

>  <LOCATION_CODE> (1,552)
PTNCS

>  <AMOUNT_CURRENT> (1,552)
33.8

$$$$
WAY-234064
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  7  2  0  0  0  0
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 13  8  2  0  0  0  0
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M  END
>  <Mol_ID> (1,553)
1306

>  <Formula> (1,553)
C15H15ClN4O2

>  <MolWeight> (1,553)
318.7582

>  <PCAT_CMPD_ID> (1,553)
WAY-234064

>  <CNC_ID> (1,553)
359313921

>  <transfer_container_id> (1,553)
PTN000000065

>  <COMPOUND_NUMBER> (1,553)
WAY-234064

>  <BAR_CODE_NO> (1,553)
3915361

>  <LOCATION_CODE> (1,553)
PTNCS

>  <AMOUNT_CURRENT> (1,553)
33.3

$$$$
WAY-312802
csChFnd80/10111816222D

 32 34  0  0  0  0  0  0  0  0999 V2000
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 18 19  1  0  0  0  0
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M  END
>  <Mol_ID> (1,554)
1307

>  <Formula> (1,554)
C26H30N4O2

>  <MolWeight> (1,554)
430.542

>  <PCAT_CMPD_ID> (1,554)
WAY-312802

>  <CNC_ID> (1,554)
359327839

>  <transfer_container_id> (1,554)
PTN000000067

>  <COMPOUND_NUMBER> (1,554)
WAY-312802

>  <BAR_CODE_NO> (1,554)
3917513

>  <LOCATION_CODE> (1,554)
PTNCS

>  <AMOUNT_CURRENT> (1,554)
33.2

$$$$
WAY-311706
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,555)
1308

>  <Formula> (1,555)
C18H24N6O3

>  <MolWeight> (1,555)
372.42156

>  <PCAT_CMPD_ID> (1,555)
WAY-311706

>  <CNC_ID> (1,555)
359315447

>  <transfer_container_id> (1,555)
PTN000000065

>  <COMPOUND_NUMBER> (1,555)
WAY-311706

>  <BAR_CODE_NO> (1,555)
3916177

>  <LOCATION_CODE> (1,555)
PTNCS

>  <AMOUNT_CURRENT> (1,555)
30.8

$$$$
WAY-310600
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  7  8  1  0  0  0  0
 16 21  1  0  0  0  0
 17 18  2  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,556)
1309

>  <Formula> (1,556)
C18H15N3O2

>  <MolWeight> (1,556)
305.3306

>  <PCAT_CMPD_ID> (1,556)
WAY-310600

>  <CNC_ID> (1,556)
359314341

>  <transfer_container_id> (1,556)
PTN000000065

>  <COMPOUND_NUMBER> (1,556)
WAY-310600

>  <BAR_CODE_NO> (1,556)
3914836

>  <LOCATION_CODE> (1,556)
PTNCS

>  <AMOUNT_CURRENT> (1,556)
33.8

$$$$
WAY-311643
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 29 30  1  0  0  0  0
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 17 18  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,557)
1310

>  <Formula> (1,557)
C21H22N4O4S

>  <MolWeight> (1,557)
426.48878

>  <PCAT_CMPD_ID> (1,557)
WAY-311643

>  <CNC_ID> (1,557)
359315384

>  <transfer_container_id> (1,557)
PTN000000065

>  <COMPOUND_NUMBER> (1,557)
WAY-311643

>  <BAR_CODE_NO> (1,557)
3916087

>  <LOCATION_CODE> (1,557)
PTNCS

>  <AMOUNT_CURRENT> (1,557)
33.5

$$$$
WAY-345262
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 12  8  1  0  0  0  0
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M  END
>  <Mol_ID> (1,558)
1311

>  <Formula> (1,558)
C23H21N3O3S

>  <MolWeight> (1,558)
419.49614

>  <PCAT_CMPD_ID> (1,558)
WAY-345262

>  <CNC_ID> (1,558)
359320554

>  <transfer_container_id> (1,558)
PTN000000065

>  <COMPOUND_NUMBER> (1,558)
WAY-345262

>  <BAR_CODE_NO> (1,558)
2555492

>  <LOCATION_CODE> (1,558)
PTNCS

>  <AMOUNT_CURRENT> (1,558)
29.4

$$$$
WAY-118264
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,559)
1312

>  <Formula> (1,559)
C18H18N2OS

>  <MolWeight> (1,559)
310.41332

>  <PCAT_CMPD_ID> (1,559)
WAY-118264

>  <CNC_ID> (1,559)
359326833

>  <transfer_container_id> (1,559)
PTN000000067

>  <COMPOUND_NUMBER> (1,559)
WAY-118264

>  <BAR_CODE_NO> (1,559)
3918018

>  <LOCATION_CODE> (1,559)
PTNCS

>  <AMOUNT_CURRENT> (1,559)
33.9

$$$$
WAY-115880
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,560)
1313

>  <Formula> (1,560)
C16H22N2O2S

>  <MolWeight> (1,560)
306.42308

>  <PCAT_CMPD_ID> (1,560)
WAY-115880

>  <CNC_ID> (1,560)
359313707

>  <transfer_container_id> (1,560)
PTN000000065

>  <COMPOUND_NUMBER> (1,560)
WAY-115880

>  <BAR_CODE_NO> (1,560)
3916066

>  <LOCATION_CODE> (1,560)
PTNCS

>  <AMOUNT_CURRENT> (1,560)
33.2

$$$$
WL-103296
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,561)
1314

>  <Formula> (1,561)
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>  <MolWeight> (1,561)
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>  <PCAT_CMPD_ID> (1,561)
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>  <CNC_ID> (1,561)
359339811

>  <transfer_container_id> (1,561)
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>  <COMPOUND_NUMBER> (1,561)
WL-103296

>  <BAR_CODE_NO> (1,561)
3918014

>  <LOCATION_CODE> (1,561)
PTNCS

>  <AMOUNT_CURRENT> (1,561)
33

$$$$
WL-127501
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,562)
1315

>  <Formula> (1,562)
C14H14N2O4

>  <MolWeight> (1,562)
274.27196

>  <PCAT_CMPD_ID> (1,562)
WL-127501

>  <CNC_ID> (1,562)
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>  <transfer_container_id> (1,562)
PTN000000067

>  <COMPOUND_NUMBER> (1,562)
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>  <BAR_CODE_NO> (1,562)
3917404

>  <LOCATION_CODE> (1,562)
PTNCS

>  <AMOUNT_CURRENT> (1,562)
33.4

$$$$
WL-390968
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,563)
1316

>  <Formula> (1,563)
C19H23BrO6

>  <MolWeight> (1,563)
427.28632

>  <PCAT_CMPD_ID> (1,563)
WL-390968

>  <CNC_ID> (1,563)
359339828

>  <transfer_container_id> (1,563)
PTN000000067

>  <COMPOUND_NUMBER> (1,563)
WL-390968

>  <BAR_CODE_NO> (1,563)
3917665

>  <LOCATION_CODE> (1,563)
PTNCS

>  <AMOUNT_CURRENT> (1,563)
33.1

$$$$
CL-241969
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,564)
1317

>  <Formula> (1,564)
C14H11NO2

>  <MolWeight> (1,564)
225.24264

>  <PCAT_CMPD_ID> (1,564)
CL-241969

>  <CNC_ID> (1,564)
359339844

>  <transfer_container_id> (1,564)
PTN000000068

>  <COMPOUND_NUMBER> (1,564)
CL-241969

>  <BAR_CODE_NO> (1,564)
3899238

>  <LOCATION_CODE> (1,564)
PTNCS

>  <AMOUNT_CURRENT> (1,564)
33.4

$$$$
CL-271149
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,565)
1318

>  <Formula> (1,565)
C15H10O4

>  <MolWeight> (1,565)
254.2375

>  <PCAT_CMPD_ID> (1,565)
CL-271149

>  <CNC_ID> (1,565)
359339849

>  <transfer_container_id> (1,565)
PTN000000068

>  <COMPOUND_NUMBER> (1,565)
CL-271149

>  <BAR_CODE_NO> (1,565)
3898220

>  <LOCATION_CODE> (1,565)
PTNCS

>  <AMOUNT_CURRENT> (1,565)
33.3

$$$$
CL-394221
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,566)
1319

>  <Formula> (1,566)
C15H24N6O2

>  <MolWeight> (1,566)
320.39006

>  <PCAT_CMPD_ID> (1,566)
CL-394221

>  <CNC_ID> (1,566)
359339874

>  <transfer_container_id> (1,566)
PTN000000068

>  <COMPOUND_NUMBER> (1,566)
CL-394221

>  <BAR_CODE_NO> (1,566)
3898902

>  <LOCATION_CODE> (1,566)
PTNCS

>  <AMOUNT_CURRENT> (1,566)
33.2

$$$$
CL-401096
csChFnd80/10111816222D

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 25 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,567)
1320

>  <Formula> (1,567)
C20H15N3O5

>  <MolWeight> (1,567)
377.3502

>  <PCAT_CMPD_ID> (1,567)
CL-401096

>  <CNC_ID> (1,567)
359339878

>  <transfer_container_id> (1,567)
PTN000000068

>  <COMPOUND_NUMBER> (1,567)
CL-401096

>  <BAR_CODE_NO> (1,567)
3898164

>  <LOCATION_CODE> (1,567)
PTNCS

>  <AMOUNT_CURRENT> (1,567)
33.2

$$$$
CL-403078
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  8 13  1  0  0  0  0
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M  END
>  <Mol_ID> (1,568)
1321

>  <Formula> (1,568)
C19H15N3O4S

>  <MolWeight> (1,568)
381.4051

>  <PCAT_CMPD_ID> (1,568)
CL-403078

>  <CNC_ID> (1,568)
359339882

>  <transfer_container_id> (1,568)
PTN000000068

>  <COMPOUND_NUMBER> (1,568)
CL-403078

>  <BAR_CODE_NO> (1,568)
3898344

>  <LOCATION_CODE> (1,568)
PTNCS

>  <AMOUNT_CURRENT> (1,568)
33.3

$$$$
CL-414430
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,569)
1322

>  <Formula> (1,569)
C18H18ClN5O2

>  <MolWeight> (1,569)
371.82082

>  <PCAT_CMPD_ID> (1,569)
CL-414430

>  <CNC_ID> (1,569)
359339910

>  <transfer_container_id> (1,569)
PTN000000068

>  <COMPOUND_NUMBER> (1,569)
CL-414430

>  <BAR_CODE_NO> (1,569)
3897947

>  <LOCATION_CODE> (1,569)
PTNCS

>  <AMOUNT_CURRENT> (1,569)
33.1

$$$$
CL-416406
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,570)
1323

>  <Formula> (1,570)
C20H17F3N6O

>  <MolWeight> (1,570)
414.3837896

>  <PCAT_CMPD_ID> (1,570)
CL-416406

>  <CNC_ID> (1,570)
359339918

>  <transfer_container_id> (1,570)
PTN000000068

>  <COMPOUND_NUMBER> (1,570)
CL-416406

>  <BAR_CODE_NO> (1,570)
3899052

>  <LOCATION_CODE> (1,570)
PTNCS

>  <AMOUNT_CURRENT> (1,570)
33.4

$$$$
CL-417231
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 16 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,571)
1324

>  <Formula> (1,571)
C15H9NO6

>  <MolWeight> (1,571)
299.23506

>  <PCAT_CMPD_ID> (1,571)
CL-417231

>  <CNC_ID> (1,571)
359339921

>  <transfer_container_id> (1,571)
PTN000000068

>  <COMPOUND_NUMBER> (1,571)
CL-417231

>  <BAR_CODE_NO> (1,571)
3898456

>  <LOCATION_CODE> (1,571)
PTNCS

>  <AMOUNT_CURRENT> (1,571)
33.2

$$$$
CL-418233
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,572)
1325

>  <Formula> (1,572)
C22H17F4N5O2

>  <MolWeight> (1,572)
459.3962928

>  <PCAT_CMPD_ID> (1,572)
CL-418233

>  <CNC_ID> (1,572)
359339927

>  <transfer_container_id> (1,572)
PTN000000068

>  <COMPOUND_NUMBER> (1,572)
CL-418233

>  <BAR_CODE_NO> (1,572)
3898136

>  <LOCATION_CODE> (1,572)
PTNCS

>  <AMOUNT_CURRENT> (1,572)
33.3

$$$$
CL-421423
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
 15 17  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,573)
1326

>  <Formula> (1,573)
C16H13ClN2O3

>  <MolWeight> (1,573)
316.73902

>  <PCAT_CMPD_ID> (1,573)
CL-421423

>  <CNC_ID> (1,573)
359339932

>  <transfer_container_id> (1,573)
PTN000000068

>  <COMPOUND_NUMBER> (1,573)
CL-421423

>  <BAR_CODE_NO> (1,573)
3898960

>  <LOCATION_CODE> (1,573)
PTNCS

>  <AMOUNT_CURRENT> (1,573)
33.4

$$$$
CL-425381
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,574)
1327

>  <Formula> (1,574)
C21H19BrN2O3

>  <MolWeight> (1,574)
427.29116

>  <PCAT_CMPD_ID> (1,574)
CL-425381

>  <CNC_ID> (1,574)
359339946

>  <transfer_container_id> (1,574)
PTN000000068

>  <COMPOUND_NUMBER> (1,574)
CL-425381

>  <BAR_CODE_NO> (1,574)
3897540

>  <LOCATION_CODE> (1,574)
PTNCS

>  <AMOUNT_CURRENT> (1,574)
33.3

$$$$
CL-45611
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,575)
1328

>  <Formula> (1,575)
C23H27N3O4

>  <MolWeight> (1,575)
409.47818

>  <PCAT_CMPD_ID> (1,575)
CL-45611

>  <CNC_ID> (1,575)
359339964

>  <transfer_container_id> (1,575)
PTN000000068

>  <COMPOUND_NUMBER> (1,575)
CL-45611

>  <BAR_CODE_NO> (1,575)
3897284

>  <LOCATION_CODE> (1,575)
PTNCS

>  <AMOUNT_CURRENT> (1,575)
33.4

$$$$
GI-523479
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,576)
1329

>  <Formula> (1,576)
C16H17N3O2

>  <MolWeight> (1,576)
283.32508

>  <PCAT_CMPD_ID> (1,576)
GI-523479

>  <CNC_ID> (1,576)
359339976

>  <transfer_container_id> (1,576)
PTN000000068

>  <COMPOUND_NUMBER> (1,576)
GI-523479

>  <BAR_CODE_NO> (1,576)
3899226

>  <LOCATION_CODE> (1,576)
PTNCS

>  <AMOUNT_CURRENT> (1,576)
33.3

$$$$
GI-531449
csChFnd80/10111816222D

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 11 14  1  0  0  0  0
 16 20  1  0  0  0  0
 19 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,577)
1330

>  <Formula> (1,577)
C17H11BrN2O2

>  <MolWeight> (1,577)
355.18544

>  <PCAT_CMPD_ID> (1,577)
GI-531449

>  <CNC_ID> (1,577)
359339983

>  <transfer_container_id> (1,577)
PTN000000068

>  <COMPOUND_NUMBER> (1,577)
GI-531449

>  <BAR_CODE_NO> (1,577)
3899011

>  <LOCATION_CODE> (1,577)
PTNCS

>  <AMOUNT_CURRENT> (1,577)
33.1

$$$$
GI-551650
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  6  8  1  0  0  0  0
 10 13  1  0  0  0  0
 20 21  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,578)
1331

>  <Formula> (1,578)
C20H14BrNO3

>  <MolWeight> (1,578)
396.23406

>  <PCAT_CMPD_ID> (1,578)
GI-551650

>  <CNC_ID> (1,578)
359339984

>  <transfer_container_id> (1,578)
PTN000000068

>  <COMPOUND_NUMBER> (1,578)
GI-551650

>  <BAR_CODE_NO> (1,578)
3897956

>  <LOCATION_CODE> (1,578)
PTNCS

>  <AMOUNT_CURRENT> (1,578)
33.1

$$$$
GI-566989
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 15  1  0  0  0  0
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 13 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
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 11 15  1  0  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,579)
1332

>  <Formula> (1,579)
C16H20O3

>  <MolWeight> (1,579)
260.3282

>  <PCAT_CMPD_ID> (1,579)
GI-566989

>  <CNC_ID> (1,579)
359339993

>  <transfer_container_id> (1,579)
PTN000000068

>  <COMPOUND_NUMBER> (1,579)
GI-566989

>  <BAR_CODE_NO> (1,579)
3897856

>  <LOCATION_CODE> (1,579)
PTNCS

>  <AMOUNT_CURRENT> (1,579)
33.1

$$$$
WAY-236381-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  7 10  2  0  0  0  0
 13 15  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,580)
1580

>  <Formula> (1,580)
C17H22N2O2

>  <MolWeight> (1,580)
286.36878

>  <PCAT_CMPD_ID> (1,580)
WAY-236381-A

>  <CNC_ID> (1,580)
359354156

>  <transfer_container_id> (1,580)
PTN000000069

>  <COMPOUND_NUMBER> (1,580)
WAY-236381-A

>  <BAR_CODE_NO> (1,580)
3899614

>  <LOCATION_CODE> (1,580)
PTNCS

>  <AMOUNT_CURRENT> (1,580)
33.4

$$$$
WAY-238081
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 22 24  2  0  0  0  0
  7 11  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,581)
1581

>  <Formula> (1,581)
C20H15NO2S

>  <MolWeight> (1,581)
333.4036

>  <PCAT_CMPD_ID> (1,581)
WAY-238081

>  <CNC_ID> (1,581)
359354173

>  <transfer_container_id> (1,581)
PTN000000069

>  <COMPOUND_NUMBER> (1,581)
WAY-238081

>  <BAR_CODE_NO> (1,581)
3901057

>  <LOCATION_CODE> (1,581)
PTNCS

>  <AMOUNT_CURRENT> (1,581)
33.5

$$$$
WAY-238413
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 26 20  2  0  0  0  0
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M  END
>  <Mol_ID> (1,582)
1582

>  <Formula> (1,582)
C21H16ClN3O2

>  <MolWeight> (1,582)
377.82364

>  <PCAT_CMPD_ID> (1,582)
WAY-238413

>  <CNC_ID> (1,582)
359354175

>  <transfer_container_id> (1,582)
PTN000000069

>  <COMPOUND_NUMBER> (1,582)
WAY-238413

>  <BAR_CODE_NO> (1,582)
3900898

>  <LOCATION_CODE> (1,582)
PTNCS

>  <AMOUNT_CURRENT> (1,582)
33.2

$$$$
WAY-238601
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  7  2  0  0  0  0
 12  4  2  0  0  0  0
 13  3  2  0  0  0  0
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 17 10  2  0  0  0  0
 18  1  1  0  0  0  0
 19  1  1  0  0  0  0
 20  2  1  0  0  0  0
 21  2  1  0  0  0  0
  2  6  1  0  0  0  0
 14  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,583)
1583

>  <Formula> (1,583)
C15H17NO5

>  <MolWeight> (1,583)
291.29918

>  <PCAT_CMPD_ID> (1,583)
WAY-238601

>  <CNC_ID> (1,583)
359354182

>  <transfer_container_id> (1,583)
PTN000000069

>  <COMPOUND_NUMBER> (1,583)
WAY-238601

>  <BAR_CODE_NO> (1,583)
3900169

>  <LOCATION_CODE> (1,583)
PTNCS

>  <AMOUNT_CURRENT> (1,583)
33.2

$$$$
WAY-238811
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
  7  9  2  0  0  0  0
 17 18  2  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,584)
1584

>  <Formula> (1,584)
C17H14N2O4S

>  <MolWeight> (1,584)
342.36906

>  <PCAT_CMPD_ID> (1,584)
WAY-238811

>  <CNC_ID> (1,584)
359354187

>  <transfer_container_id> (1,584)
PTN000000069

>  <COMPOUND_NUMBER> (1,584)
WAY-238811

>  <BAR_CODE_NO> (1,584)
3899926

>  <LOCATION_CODE> (1,584)
PTNCS

>  <AMOUNT_CURRENT> (1,584)
33.3

$$$$
WAY-298109
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,585)
1585

>  <Formula> (1,585)
C10H10O3S

>  <MolWeight> (1,585)
210.2496

>  <PCAT_CMPD_ID> (1,585)
WAY-298109

>  <CNC_ID> (1,585)
359357103

>  <transfer_container_id> (1,585)
PTN000000069

>  <COMPOUND_NUMBER> (1,585)
WAY-298109

>  <BAR_CODE_NO> (1,585)
3899451

>  <LOCATION_CODE> (1,585)
PTNCS

>  <AMOUNT_CURRENT> (1,585)
33.3

$$$$
WAY-298110
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,586)
1586

>  <Formula> (1,586)
C11H7N3O2S

>  <MolWeight> (1,586)
245.25718

>  <PCAT_CMPD_ID> (1,586)
WAY-298110

>  <CNC_ID> (1,586)
359357104

>  <transfer_container_id> (1,586)
PTN000000069

>  <COMPOUND_NUMBER> (1,586)
WAY-298110

>  <BAR_CODE_NO> (1,586)
3899452

>  <LOCATION_CODE> (1,586)
PTNCS

>  <AMOUNT_CURRENT> (1,586)
33

$$$$
WAY-298129
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,587)
1587

>  <Formula> (1,587)
C13H15NO2S

>  <MolWeight> (1,587)
249.3287

>  <PCAT_CMPD_ID> (1,587)
WAY-298129

>  <CNC_ID> (1,587)
359357123

>  <transfer_container_id> (1,587)
PTN000000069

>  <COMPOUND_NUMBER> (1,587)
WAY-298129

>  <BAR_CODE_NO> (1,587)
3899472

>  <LOCATION_CODE> (1,587)
PTNCS

>  <AMOUNT_CURRENT> (1,587)
33.4

$$$$
WAY-298132
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,588)
1588

>  <Formula> (1,588)
C16H13ClN2O2

>  <MolWeight> (1,588)
300.73962

>  <PCAT_CMPD_ID> (1,588)
WAY-298132

>  <CNC_ID> (1,588)
359357126

>  <transfer_container_id> (1,588)
PTN000000069

>  <COMPOUND_NUMBER> (1,588)
WAY-298132

>  <BAR_CODE_NO> (1,588)
3899475

>  <LOCATION_CODE> (1,588)
PTNCS

>  <AMOUNT_CURRENT> (1,588)
33.3

$$$$
WAY-298144-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,589)
1589

>  <Formula> (1,589)
C13H20N2O

>  <MolWeight> (1,589)
220.3107

>  <PCAT_CMPD_ID> (1,589)
WAY-298144-A

>  <CNC_ID> (1,589)
359357138

>  <transfer_container_id> (1,589)
PTN000000069

>  <COMPOUND_NUMBER> (1,589)
WAY-298144-A

>  <BAR_CODE_NO> (1,589)
3899491

>  <LOCATION_CODE> (1,589)
PTNCS

>  <AMOUNT_CURRENT> (1,589)
33.3

$$$$
WAY-298145
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,590)
1590

>  <Formula> (1,590)
C17H15ClN4OS2

>  <MolWeight> (1,590)
390.9102

>  <PCAT_CMPD_ID> (1,590)
WAY-298145

>  <CNC_ID> (1,590)
359357139

>  <transfer_container_id> (1,590)
PTN000000069

>  <COMPOUND_NUMBER> (1,590)
WAY-298145

>  <BAR_CODE_NO> (1,590)
3899492

>  <LOCATION_CODE> (1,590)
PTNCS

>  <AMOUNT_CURRENT> (1,590)
33.5

$$$$
WAY-298207
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,591)
1591

>  <Formula> (1,591)
C20H15F3N4O3

>  <MolWeight> (1,591)
416.3533096

>  <PCAT_CMPD_ID> (1,591)
WAY-298207

>  <CNC_ID> (1,591)
359357201

>  <transfer_container_id> (1,591)
PTN000000069

>  <COMPOUND_NUMBER> (1,591)
WAY-298207

>  <BAR_CODE_NO> (1,591)
3899581

>  <LOCATION_CODE> (1,591)
PTNCS

>  <AMOUNT_CURRENT> (1,591)
33.4

$$$$
WAY-298211
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,592)
1592

>  <Formula> (1,592)
C18H19ClN2O3S

>  <MolWeight> (1,592)
378.87306

>  <PCAT_CMPD_ID> (1,592)
WAY-298211

>  <CNC_ID> (1,592)
359357205

>  <transfer_container_id> (1,592)
PTN000000069

>  <COMPOUND_NUMBER> (1,592)
WAY-298211

>  <BAR_CODE_NO> (1,592)
3899585

>  <LOCATION_CODE> (1,592)
PTNCS

>  <AMOUNT_CURRENT> (1,592)
33.3

$$$$
WAY-298228
csChFnd80/10111816222D

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  7  9  1  0  0  0  0
 11 14  1  0  0  0  0
 19 21  1  0  0  0  0
 26 27  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (1,593)
1593

>  <Formula> (1,593)
C22H22ClN3O4

>  <MolWeight> (1,593)
427.88078

>  <PCAT_CMPD_ID> (1,593)
WAY-298228

>  <CNC_ID> (1,593)
359357222

>  <transfer_container_id> (1,593)
PTN000000069

>  <COMPOUND_NUMBER> (1,593)
WAY-298228

>  <BAR_CODE_NO> (1,593)
3899613

>  <LOCATION_CODE> (1,593)
PTNCS

>  <AMOUNT_CURRENT> (1,593)
33.2

$$$$
WAY-298250
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 12 15  2  0  0  0  0
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 14 17  2  0  0  0  0
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 16 20  1  0  0  0  0
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 18 23  2  0  0  0  0
 21 24  2  0  0  0  0
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 26 27  1  0  0  0  0
  8 11  2  0  0  0  0
 19 20  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,594)
1594

>  <Formula> (1,594)
C20H18N2O5

>  <MolWeight> (1,594)
366.36732

>  <PCAT_CMPD_ID> (1,594)
WAY-298250

>  <CNC_ID> (1,594)
359357244

>  <transfer_container_id> (1,594)
PTN000000069

>  <COMPOUND_NUMBER> (1,594)
WAY-298250

>  <BAR_CODE_NO> (1,594)
3899646

>  <LOCATION_CODE> (1,594)
PTNCS

>  <AMOUNT_CURRENT> (1,594)
33.2

$$$$
WAY-298257
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11 14  1  0  0  0  0
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  5  7  2  0  0  0  0
 21 24  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,595)
1595

>  <Formula> (1,595)
C18H16ClN3O2S

>  <MolWeight> (1,595)
373.85654

>  <PCAT_CMPD_ID> (1,595)
WAY-298257

>  <CNC_ID> (1,595)
359357251

>  <transfer_container_id> (1,595)
PTN000000069

>  <COMPOUND_NUMBER> (1,595)
WAY-298257

>  <BAR_CODE_NO> (1,595)
3899660

>  <LOCATION_CODE> (1,595)
PTNCS

>  <AMOUNT_CURRENT> (1,595)
33

$$$$
WAY-298265
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
 13 16  2  0  0  0  0
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  5  9  1  0  0  0  0
 14 16  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,596)
1596

>  <Formula> (1,596)
C16H14N2O3

>  <MolWeight> (1,596)
282.29396

>  <PCAT_CMPD_ID> (1,596)
WAY-298265

>  <CNC_ID> (1,596)
359357259

>  <transfer_container_id> (1,596)
PTN000000069

>  <COMPOUND_NUMBER> (1,596)
WAY-298265

>  <BAR_CODE_NO> (1,596)
3899669

>  <LOCATION_CODE> (1,596)
PTNCS

>  <AMOUNT_CURRENT> (1,596)
33.4

$$$$
WAY-298289
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,597)
1597

>  <Formula> (1,597)
C11H12N2O2S

>  <MolWeight> (1,597)
236.29018

>  <PCAT_CMPD_ID> (1,597)
WAY-298289

>  <CNC_ID> (1,597)
359357283

>  <transfer_container_id> (1,597)
PTN000000069

>  <COMPOUND_NUMBER> (1,597)
WAY-298289

>  <BAR_CODE_NO> (1,597)
3899696

>  <LOCATION_CODE> (1,597)
PTNCS

>  <AMOUNT_CURRENT> (1,597)
33.1

$$$$
WAY-298313
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,598)
1598

>  <Formula> (1,598)
C17H20N2O5

>  <MolWeight> (1,598)
332.3511

>  <PCAT_CMPD_ID> (1,598)
WAY-298313

>  <CNC_ID> (1,598)
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>  <transfer_container_id> (1,598)
PTN000000069

>  <COMPOUND_NUMBER> (1,598)
WAY-298313

>  <BAR_CODE_NO> (1,598)
3899725

>  <LOCATION_CODE> (1,598)
PTNCS

>  <AMOUNT_CURRENT> (1,598)
33.1

$$$$
WAY-298318
csChFnd80/10111816222D

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 13  9  2  0  0  0  0
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 18  8  1  0  0  0  0
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 17 10  2  0  0  0  0
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M  END
>  <Mol_ID> (1,599)
1599

>  <Formula> (1,599)
C16H13FN2O

>  <MolWeight> (1,599)
268.2856232

>  <PCAT_CMPD_ID> (1,599)
WAY-298318

>  <CNC_ID> (1,599)
359357312

>  <transfer_container_id> (1,599)
PTN000000069

>  <COMPOUND_NUMBER> (1,599)
WAY-298318

>  <BAR_CODE_NO> (1,599)
3899732

>  <LOCATION_CODE> (1,599)
PTNCS

>  <AMOUNT_CURRENT> (1,599)
33.2

$$$$
WAY-298363
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 26 27  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (1,600)
1600

>  <Formula> (1,600)
C21H17ClN2O5S

>  <MolWeight> (1,600)
444.88808

>  <PCAT_CMPD_ID> (1,600)
WAY-298363

>  <CNC_ID> (1,600)
359357357

>  <transfer_container_id> (1,600)
PTN000000069

>  <COMPOUND_NUMBER> (1,600)
WAY-298363

>  <BAR_CODE_NO> (1,600)
3899807

>  <LOCATION_CODE> (1,600)
PTNCS

>  <AMOUNT_CURRENT> (1,600)
33.1

$$$$
WAY-298399
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 12  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,601)
1601

>  <Formula> (1,601)
C13H16ClN5O

>  <MolWeight> (1,601)
293.75204

>  <PCAT_CMPD_ID> (1,601)
WAY-298399

>  <CNC_ID> (1,601)
359357393

>  <transfer_container_id> (1,601)
PTN000000069

>  <COMPOUND_NUMBER> (1,601)
WAY-298399

>  <BAR_CODE_NO> (1,601)
3899861

>  <LOCATION_CODE> (1,601)
PTNCS

>  <AMOUNT_CURRENT> (1,601)
33.2

$$$$
WAY-298410
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,602)
1602

>  <Formula> (1,602)
C26H29NO6

>  <MolWeight> (1,602)
451.51156

>  <PCAT_CMPD_ID> (1,602)
WAY-298410

>  <CNC_ID> (1,602)
359357404

>  <transfer_container_id> (1,602)
PTN000000069

>  <COMPOUND_NUMBER> (1,602)
WAY-298410

>  <BAR_CODE_NO> (1,602)
3899876

>  <LOCATION_CODE> (1,602)
PTNCS

>  <AMOUNT_CURRENT> (1,602)
33.4

$$$$
WAY-298411
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 13 15  2  0  0  0  0
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M  END
>  <Mol_ID> (1,603)
1603

>  <Formula> (1,603)
C17H12ClN3O3S

>  <MolWeight> (1,603)
373.81348

>  <PCAT_CMPD_ID> (1,603)
WAY-298411

>  <CNC_ID> (1,603)
359357405

>  <transfer_container_id> (1,603)
PTN000000069

>  <COMPOUND_NUMBER> (1,603)
WAY-298411

>  <BAR_CODE_NO> (1,603)
3899883

>  <LOCATION_CODE> (1,603)
PTNCS

>  <AMOUNT_CURRENT> (1,603)
33.2

$$$$
WAY-298414
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
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 18 20  1  0  0  0  0
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 22 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,604)
1604

>  <Formula> (1,604)
C17H17N3O3S

>  <MolWeight> (1,604)
343.40018

>  <PCAT_CMPD_ID> (1,604)
WAY-298414

>  <CNC_ID> (1,604)
359357408

>  <transfer_container_id> (1,604)
PTN000000069

>  <COMPOUND_NUMBER> (1,604)
WAY-298414

>  <BAR_CODE_NO> (1,604)
3899887

>  <LOCATION_CODE> (1,604)
PTNCS

>  <AMOUNT_CURRENT> (1,604)
33.1

$$$$
WAY-298417
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
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  8 10  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,605)
1605

>  <Formula> (1,605)
C13H11BrN2O

>  <MolWeight> (1,605)
291.14324

>  <PCAT_CMPD_ID> (1,605)
WAY-298417

>  <CNC_ID> (1,605)
359357411

>  <transfer_container_id> (1,605)
PTN000000069

>  <COMPOUND_NUMBER> (1,605)
WAY-298417

>  <BAR_CODE_NO> (1,605)
3899890

>  <LOCATION_CODE> (1,605)
PTNCS

>  <AMOUNT_CURRENT> (1,605)
33.4

$$$$
WAY-298443
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 22 25  1  0  0  0  0
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M  END
>  <Mol_ID> (1,606)
1606

>  <Formula> (1,606)
C26H28N2O4

>  <MolWeight> (1,606)
432.51152

>  <PCAT_CMPD_ID> (1,606)
WAY-298443

>  <CNC_ID> (1,606)
359357437

>  <transfer_container_id> (1,606)
PTN000000069

>  <COMPOUND_NUMBER> (1,606)
WAY-298443

>  <BAR_CODE_NO> (1,606)
3899920

>  <LOCATION_CODE> (1,606)
PTNCS

>  <AMOUNT_CURRENT> (1,606)
33

$$$$
WAY-298450
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,607)
1607

>  <Formula> (1,607)
C13H14N2O3

>  <MolWeight> (1,607)
246.26186

>  <PCAT_CMPD_ID> (1,607)
WAY-298450

>  <CNC_ID> (1,607)
359357444

>  <transfer_container_id> (1,607)
PTN000000069

>  <COMPOUND_NUMBER> (1,607)
WAY-298450

>  <BAR_CODE_NO> (1,607)
3899930

>  <LOCATION_CODE> (1,607)
PTNCS

>  <AMOUNT_CURRENT> (1,607)
33.2

$$$$
WAY-298451
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  6  1  0  0  0  0
  4  2  1  0  0  0  0
  5  7  1  0  0  0  0
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  8 12  1  0  0  0  0
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 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12  1  1  0  0  0  0
 13  4  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  2  0  0  0  0
 16  3  2  0  0  0  0
 17 11  2  0  0  0  0
 18 11  1  0  0  0  0
 19 10  1  0  0  0  0
 20 13  1  0  0  0  0
 21 15  1  0  0  0  0
 22 19  2  0  0  0  0
 23 22  1  0  0  0  0
  5 15  1  0  0  0  0
 21 23  2  0  0  0  0
 14 13  2  0  0  0  0
M  END
>  <Mol_ID> (1,608)
1608

>  <Formula> (1,608)
C17H16N2O4

>  <MolWeight> (1,608)
312.31994

>  <PCAT_CMPD_ID> (1,608)
WAY-298451

>  <CNC_ID> (1,608)
359357445

>  <transfer_container_id> (1,608)
PTN000000069

>  <COMPOUND_NUMBER> (1,608)
WAY-298451

>  <BAR_CODE_NO> (1,608)
3899931

>  <LOCATION_CODE> (1,608)
PTNCS

>  <AMOUNT_CURRENT> (1,608)
33.2

$$$$
WAY-298457
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
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  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
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 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 14 17  1  0  0  0  0
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 18 20  1  0  0  0  0
 18 21  2  0  0  0  0
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 25 26  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,609)
1609

>  <Formula> (1,609)
C20H23N3O3

>  <MolWeight> (1,609)
353.41492

>  <PCAT_CMPD_ID> (1,609)
WAY-298457

>  <CNC_ID> (1,609)
359357451

>  <transfer_container_id> (1,609)
PTN000000069

>  <COMPOUND_NUMBER> (1,609)
WAY-298457

>  <BAR_CODE_NO> (1,609)
3899947

>  <LOCATION_CODE> (1,609)
PTNCS

>  <AMOUNT_CURRENT> (1,609)
33.4

$$$$
WAY-298458
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  1  1  0  0  0  0
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 10 11  1  0  0  0  0
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 12  8  1  0  0  0  0
 13  6  2  0  0  0  0
 14 10  2  0  0  0  0
 15  9  1  0  0  0  0
 16  9  2  0  0  0  0
 17 16  1  0  0  0  0
 18 15  2  0  0  0  0
 19 10  1  0  0  0  0
 20  7  1  0  0  0  0
 21  7  1  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
  4  3  1  0  0  0  0
 18 11  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,610)
1610

>  <Formula> (1,610)
C15H17N5O3S

>  <MolWeight> (1,610)
347.39218

>  <PCAT_CMPD_ID> (1,610)
WAY-298458

>  <CNC_ID> (1,610)
359357452

>  <transfer_container_id> (1,610)
PTN000000069

>  <COMPOUND_NUMBER> (1,610)
WAY-298458

>  <BAR_CODE_NO> (1,610)
3899949

>  <LOCATION_CODE> (1,610)
PTNCS

>  <AMOUNT_CURRENT> (1,610)
33.4

$$$$
WAY-298463-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 20 24  1  0  0  0  0
 21 25  2  0  0  0  0
  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
 22 25  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,611)
1611

>  <Formula> (1,611)
C20H19N3O2

>  <MolWeight> (1,611)
333.38376

>  <PCAT_CMPD_ID> (1,611)
WAY-298463-A

>  <CNC_ID> (1,611)
359357457

>  <transfer_container_id> (1,611)
PTN000000069

>  <COMPOUND_NUMBER> (1,611)
WAY-298463-A

>  <BAR_CODE_NO> (1,611)
3899958

>  <LOCATION_CODE> (1,611)
PTNCS

>  <AMOUNT_CURRENT> (1,611)
33.4

$$$$
WAY-298466
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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 25 20  1  0  0  0  0
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M  END
>  <Mol_ID> (1,612)
1612

>  <Formula> (1,612)
C17H14ClN3O3S2

>  <MolWeight> (1,612)
407.89436

>  <PCAT_CMPD_ID> (1,612)
WAY-298466

>  <CNC_ID> (1,612)
359357460

>  <transfer_container_id> (1,612)
PTN000000069

>  <COMPOUND_NUMBER> (1,612)
WAY-298466

>  <BAR_CODE_NO> (1,612)
3899961

>  <LOCATION_CODE> (1,612)
PTNCS

>  <AMOUNT_CURRENT> (1,612)
33

$$$$
WAY-298492
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,613)
1613

>  <Formula> (1,613)
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>  <MolWeight> (1,613)
305.82234

>  <PCAT_CMPD_ID> (1,613)
WAY-298492

>  <CNC_ID> (1,613)
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>  <transfer_container_id> (1,613)
PTN000000069

>  <COMPOUND_NUMBER> (1,613)
WAY-298492

>  <BAR_CODE_NO> (1,613)
3899993

>  <LOCATION_CODE> (1,613)
PTNCS

>  <AMOUNT_CURRENT> (1,613)
33.1

$$$$
WAY-298494
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,614)
1614

>  <Formula> (1,614)
C21H17ClN2O4S

>  <MolWeight> (1,614)
428.88868

>  <PCAT_CMPD_ID> (1,614)
WAY-298494

>  <CNC_ID> (1,614)
359357488

>  <transfer_container_id> (1,614)
PTN000000069

>  <COMPOUND_NUMBER> (1,614)
WAY-298494

>  <BAR_CODE_NO> (1,614)
3899995

>  <LOCATION_CODE> (1,614)
PTNCS

>  <AMOUNT_CURRENT> (1,614)
33.3

$$$$
WAY-298515
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,615)
1615

>  <Formula> (1,615)
C16H11N3O4S

>  <MolWeight> (1,615)
341.34124

>  <PCAT_CMPD_ID> (1,615)
WAY-298515

>  <CNC_ID> (1,615)
359357509

>  <transfer_container_id> (1,615)
PTN000000069

>  <COMPOUND_NUMBER> (1,615)
WAY-298515

>  <BAR_CODE_NO> (1,615)
3900022

>  <LOCATION_CODE> (1,615)
PTNCS

>  <AMOUNT_CURRENT> (1,615)
33.4

$$$$
WAY-298517
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 14 17  2  0  0  0  0
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M  END
>  <Mol_ID> (1,616)
1616

>  <Formula> (1,616)
C15H13N3OS

>  <MolWeight> (1,616)
283.34822

>  <PCAT_CMPD_ID> (1,616)
WAY-298517

>  <CNC_ID> (1,616)
359357511

>  <transfer_container_id> (1,616)
PTN000000069

>  <COMPOUND_NUMBER> (1,616)
WAY-298517

>  <BAR_CODE_NO> (1,616)
3900025

>  <LOCATION_CODE> (1,616)
PTNCS

>  <AMOUNT_CURRENT> (1,616)
33.2

$$$$
WAY-298521
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,617)
1617

>  <Formula> (1,617)
C11H12N2O3S

>  <MolWeight> (1,617)
252.28958

>  <PCAT_CMPD_ID> (1,617)
WAY-298521

>  <CNC_ID> (1,617)
359357515

>  <transfer_container_id> (1,617)
PTN000000069

>  <COMPOUND_NUMBER> (1,617)
WAY-298521

>  <BAR_CODE_NO> (1,617)
3900032

>  <LOCATION_CODE> (1,617)
PTNCS

>  <AMOUNT_CURRENT> (1,617)
33

$$$$
WAY-298523
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,618)
1618

>  <Formula> (1,618)
C16H17N5O

>  <MolWeight> (1,618)
295.33908

>  <PCAT_CMPD_ID> (1,618)
WAY-298523

>  <CNC_ID> (1,618)
359357517

>  <transfer_container_id> (1,618)
PTN000000069

>  <COMPOUND_NUMBER> (1,618)
WAY-298523

>  <BAR_CODE_NO> (1,618)
3900035

>  <LOCATION_CODE> (1,618)
PTNCS

>  <AMOUNT_CURRENT> (1,618)
33

$$$$
WAY-298530
csChFnd80/10111816222D

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 18 20  2  0  0  0  0
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 21 23  1  0  0  0  0
  7  9  1  0  0  0  0
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,619)
1619

>  <Formula> (1,619)
C18H16N2O2S

>  <MolWeight> (1,619)
324.39684

>  <PCAT_CMPD_ID> (1,619)
WAY-298530

>  <CNC_ID> (1,619)
359357524

>  <transfer_container_id> (1,619)
PTN000000069

>  <COMPOUND_NUMBER> (1,619)
WAY-298530

>  <BAR_CODE_NO> (1,619)
3900042

>  <LOCATION_CODE> (1,619)
PTNCS

>  <AMOUNT_CURRENT> (1,619)
33.2

$$$$
WAY-298546
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,620)
1620

>  <Formula> (1,620)
C19H17ClN6OS

>  <MolWeight> (1,620)
412.89588

>  <PCAT_CMPD_ID> (1,620)
WAY-298546

>  <CNC_ID> (1,620)
359357540

>  <transfer_container_id> (1,620)
PTN000000069

>  <COMPOUND_NUMBER> (1,620)
WAY-298546

>  <BAR_CODE_NO> (1,620)
3900061

>  <LOCATION_CODE> (1,620)
PTNCS

>  <AMOUNT_CURRENT> (1,620)
33.1

$$$$
WAY-298576
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 23 24  1  0  0  0  0
  5  7  1  0  0  0  0
 11 14  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,621)
1621

>  <Formula> (1,621)
C18H19N3O3

>  <MolWeight> (1,621)
325.36176

>  <PCAT_CMPD_ID> (1,621)
WAY-298576

>  <CNC_ID> (1,621)
359357570

>  <transfer_container_id> (1,621)
PTN000000069

>  <COMPOUND_NUMBER> (1,621)
WAY-298576

>  <BAR_CODE_NO> (1,621)
3900105

>  <LOCATION_CODE> (1,621)
PTNCS

>  <AMOUNT_CURRENT> (1,621)
33.1

$$$$
WAY-298579
csChFnd80/10111816222D

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 27 21  1  0  0  0  0
 28 23  1  0  0  0  0
 29 22  2  0  0  0  0
 30 25  1  0  0  0  0
 31 28  2  0  0  0  0
 10  8  1  0  0  0  0
  3  2  1  0  0  0  0
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 26 27  2  0  0  0  0
 29 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,622)
1622

>  <Formula> (1,622)
C25H25N3O2S

>  <MolWeight> (1,622)
431.5499

>  <PCAT_CMPD_ID> (1,622)
WAY-298579

>  <CNC_ID> (1,622)
359357573

>  <transfer_container_id> (1,622)
PTN000000069

>  <COMPOUND_NUMBER> (1,622)
WAY-298579

>  <BAR_CODE_NO> (1,622)
3900109

>  <LOCATION_CODE> (1,622)
PTNCS

>  <AMOUNT_CURRENT> (1,622)
33

$$$$
WAY-298597
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  7  9  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,623)
1623

>  <Formula> (1,623)
C16H19NO3S

>  <MolWeight> (1,623)
305.39196

>  <PCAT_CMPD_ID> (1,623)
WAY-298597

>  <CNC_ID> (1,623)
359357591

>  <transfer_container_id> (1,623)
PTN000000069

>  <COMPOUND_NUMBER> (1,623)
WAY-298597

>  <BAR_CODE_NO> (1,623)
3900130

>  <LOCATION_CODE> (1,623)
PTNCS

>  <AMOUNT_CURRENT> (1,623)
33.2

$$$$
WAY-298601
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  5  1  0  0  0  0
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  8  9  1  0  0  0  0
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 10 14  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  7  1  0  0  0  0
 13 14  2  0  0  0  0
 15  8  1  0  0  0  0
 16 10  1  0  0  0  0
  4 17  2  0  0  0  0
 18  5  2  0  0  0  0
 19 13  1  0  0  0  0
 20 15  1  0  0  0  0
 21 15  1  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
  3  4  1  0  0  0  0
 17 22  1  0  0  0  0
 10  8  2  0  0  0  0
M  END
>  <Mol_ID> (1,624)
1624

>  <Formula> (1,624)
C17H18N2O3S

>  <MolWeight> (1,624)
330.40142

>  <PCAT_CMPD_ID> (1,624)
WAY-298601

>  <CNC_ID> (1,624)
359357595

>  <transfer_container_id> (1,624)
PTN000000069

>  <COMPOUND_NUMBER> (1,624)
WAY-298601

>  <BAR_CODE_NO> (1,624)
3900134

>  <LOCATION_CODE> (1,624)
PTNCS

>  <AMOUNT_CURRENT> (1,624)
33.3

$$$$
WAY-298606
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 14 19  2  0  0  0  0
 20 25  1  0  0  0  0
 21 23  1  0  0  0  0
 28 30  1  0  0  0  0
M  END
>  <Mol_ID> (1,625)
1625

>  <Formula> (1,625)
C24H17N3O3

>  <MolWeight> (1,625)
395.41008

>  <PCAT_CMPD_ID> (1,625)
WAY-298606

>  <CNC_ID> (1,625)
359357600

>  <transfer_container_id> (1,625)
PTN000000069

>  <COMPOUND_NUMBER> (1,625)
WAY-298606

>  <BAR_CODE_NO> (1,625)
3900141

>  <LOCATION_CODE> (1,625)
PTNCS

>  <AMOUNT_CURRENT> (1,625)
33

$$$$
WAY-298624
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  2  0  0  0  0
 18 21  1  0  0  0  0
  7 11  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,626)
1626

>  <Formula> (1,626)
C16H17ClN2O2

>  <MolWeight> (1,626)
304.77138

>  <PCAT_CMPD_ID> (1,626)
WAY-298624

>  <CNC_ID> (1,626)
359357618

>  <transfer_container_id> (1,626)
PTN000000069

>  <COMPOUND_NUMBER> (1,626)
WAY-298624

>  <BAR_CODE_NO> (1,626)
3900167

>  <LOCATION_CODE> (1,626)
PTNCS

>  <AMOUNT_CURRENT> (1,626)
33.5

$$$$
WAY-298626
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,627)
1627

>  <Formula> (1,627)
C16H20N2O5

>  <MolWeight> (1,627)
320.3404

>  <PCAT_CMPD_ID> (1,627)
WAY-298626

>  <CNC_ID> (1,627)
359357620

>  <transfer_container_id> (1,627)
PTN000000069

>  <COMPOUND_NUMBER> (1,627)
WAY-298626

>  <BAR_CODE_NO> (1,627)
3900170

>  <LOCATION_CODE> (1,627)
PTNCS

>  <AMOUNT_CURRENT> (1,627)
33.5

$$$$
WAY-298643
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
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M  END
>  <Mol_ID> (1,628)
1628

>  <Formula> (1,628)
C20H16N2O3

>  <MolWeight> (1,628)
332.35264

>  <PCAT_CMPD_ID> (1,628)
WAY-298643

>  <CNC_ID> (1,628)
359357637

>  <transfer_container_id> (1,628)
PTN000000069

>  <COMPOUND_NUMBER> (1,628)
WAY-298643

>  <BAR_CODE_NO> (1,628)
3900189

>  <LOCATION_CODE> (1,628)
PTNCS

>  <AMOUNT_CURRENT> (1,628)
33.3

$$$$
WAY-298654
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,629)
1629

>  <Formula> (1,629)
C11H11N3O2

>  <MolWeight> (1,629)
217.22394

>  <PCAT_CMPD_ID> (1,629)
WAY-298654

>  <CNC_ID> (1,629)
359357648

>  <transfer_container_id> (1,629)
PTN000000069

>  <COMPOUND_NUMBER> (1,629)
WAY-298654

>  <BAR_CODE_NO> (1,629)
3900201

>  <LOCATION_CODE> (1,629)
PTNCS

>  <AMOUNT_CURRENT> (1,629)
33.4

$$$$
WAY-298663-A
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 17 20  1  0  0  0  0
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 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,630)
1630

>  <Formula> (1,630)
C16H23NO4

>  <MolWeight> (1,630)
293.35812

>  <PCAT_CMPD_ID> (1,630)
WAY-298663-A

>  <CNC_ID> (1,630)
359357657

>  <transfer_container_id> (1,630)
PTN000000069

>  <COMPOUND_NUMBER> (1,630)
WAY-298663-A

>  <BAR_CODE_NO> (1,630)
3900210

>  <LOCATION_CODE> (1,630)
PTNCS

>  <AMOUNT_CURRENT> (1,630)
33.1

$$$$
WAY-298673
csChFnd80/10111816222D

 24 28  0  0  0  0  0  0  0  0999 V2000
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 11 12  2  0  0  0  0
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M  END
>  <Mol_ID> (1,631)
1631

>  <Formula> (1,631)
C19H15BrFNO2

>  <MolWeight> (1,631)
388.2303032

>  <PCAT_CMPD_ID> (1,631)
WAY-298673

>  <CNC_ID> (1,631)
359357667

>  <transfer_container_id> (1,631)
PTN000000069

>  <COMPOUND_NUMBER> (1,631)
WAY-298673

>  <BAR_CODE_NO> (1,631)
3900221

>  <LOCATION_CODE> (1,631)
PTNCS

>  <AMOUNT_CURRENT> (1,631)
33

$$$$
WAY-298675
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,632)
1632

>  <Formula> (1,632)
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>  <MolWeight> (1,632)
338.40028

>  <PCAT_CMPD_ID> (1,632)
WAY-298675

>  <CNC_ID> (1,632)
359357669

>  <transfer_container_id> (1,632)
PTN000000069

>  <COMPOUND_NUMBER> (1,632)
WAY-298675

>  <BAR_CODE_NO> (1,632)
3900224

>  <LOCATION_CODE> (1,632)
PTNCS

>  <AMOUNT_CURRENT> (1,632)
33.2

$$$$
WAY-298686
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,633)
1633

>  <Formula> (1,633)
C19H18ClF3N2O4S

>  <MolWeight> (1,633)
462.8704296

>  <PCAT_CMPD_ID> (1,633)
WAY-298686

>  <CNC_ID> (1,633)
359357680

>  <transfer_container_id> (1,633)
PTN000000069

>  <COMPOUND_NUMBER> (1,633)
WAY-298686

>  <BAR_CODE_NO> (1,633)
3900240

>  <LOCATION_CODE> (1,633)
PTNCS

>  <AMOUNT_CURRENT> (1,633)
33

$$$$
WAY-298690
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,634)
1634

>  <Formula> (1,634)
C18H18Br2N2O2

>  <MolWeight> (1,634)
454.15572

>  <PCAT_CMPD_ID> (1,634)
WAY-298690

>  <CNC_ID> (1,634)
359357684

>  <transfer_container_id> (1,634)
PTN000000069

>  <COMPOUND_NUMBER> (1,634)
WAY-298690

>  <BAR_CODE_NO> (1,634)
3900245

>  <LOCATION_CODE> (1,634)
PTNCS

>  <AMOUNT_CURRENT> (1,634)
33.3

$$$$
WAY-298691
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,635)
1635

>  <Formula> (1,635)
C14H10ClN3O4S

>  <MolWeight> (1,635)
351.7649

>  <PCAT_CMPD_ID> (1,635)
WAY-298691

>  <CNC_ID> (1,635)
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>  <transfer_container_id> (1,635)
PTN000000069

>  <COMPOUND_NUMBER> (1,635)
WAY-298691

>  <BAR_CODE_NO> (1,635)
3900246

>  <LOCATION_CODE> (1,635)
PTNCS

>  <AMOUNT_CURRENT> (1,635)
33.3

$$$$
WAY-298692
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,636)
1636

>  <Formula> (1,636)
C13H10ClNO2

>  <MolWeight> (1,636)
247.677

>  <PCAT_CMPD_ID> (1,636)
WAY-298692

>  <CNC_ID> (1,636)
359357686

>  <transfer_container_id> (1,636)
PTN000000069

>  <COMPOUND_NUMBER> (1,636)
WAY-298692

>  <BAR_CODE_NO> (1,636)
3900247

>  <LOCATION_CODE> (1,636)
PTNCS

>  <AMOUNT_CURRENT> (1,636)
33.4

$$$$
WAY-298693
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,637)
1637

>  <Formula> (1,637)
C19H20N2O4

>  <MolWeight> (1,637)
340.3731

>  <PCAT_CMPD_ID> (1,637)
WAY-298693

>  <CNC_ID> (1,637)
359357687

>  <transfer_container_id> (1,637)
PTN000000069

>  <COMPOUND_NUMBER> (1,637)
WAY-298693

>  <BAR_CODE_NO> (1,637)
3900248

>  <LOCATION_CODE> (1,637)
PTNCS

>  <AMOUNT_CURRENT> (1,637)
33.2

$$$$
WAY-298722-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 15 16  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,638)
1638

>  <Formula> (1,638)
C20H20FN3O

>  <MolWeight> (1,638)
337.3907032

>  <PCAT_CMPD_ID> (1,638)
WAY-298722-A

>  <CNC_ID> (1,638)
359357716

>  <transfer_container_id> (1,638)
PTN000000069

>  <COMPOUND_NUMBER> (1,638)
WAY-298722-A

>  <BAR_CODE_NO> (1,638)
3900282

>  <LOCATION_CODE> (1,638)
PTNCS

>  <AMOUNT_CURRENT> (1,638)
33.5

$$$$
WAY-298724
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    0.7103    1.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 20 23  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,639)
1639

>  <Formula> (1,639)
C25H32N2O3

>  <MolWeight> (1,639)
408.53318

>  <PCAT_CMPD_ID> (1,639)
WAY-298724

>  <CNC_ID> (1,639)
359357718

>  <transfer_container_id> (1,639)
PTN000000069

>  <COMPOUND_NUMBER> (1,639)
WAY-298724

>  <BAR_CODE_NO> (1,639)
3900285

>  <LOCATION_CODE> (1,639)
PTNCS

>  <AMOUNT_CURRENT> (1,639)
33.4

$$$$
WAY-298740
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
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 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
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 16  8  1  0  0  0  0
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 25 24  1  0  0  0  0
  2  4  2  0  0  0  0
 25 22  2  0  0  0  0
 17 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,640)
1640

>  <Formula> (1,640)
C18H15ClN2O3S

>  <MolWeight> (1,640)
374.8413

>  <PCAT_CMPD_ID> (1,640)
WAY-298740

>  <CNC_ID> (1,640)
359357734

>  <transfer_container_id> (1,640)
PTN000000069

>  <COMPOUND_NUMBER> (1,640)
WAY-298740

>  <BAR_CODE_NO> (1,640)
3900304

>  <LOCATION_CODE> (1,640)
PTNCS

>  <AMOUNT_CURRENT> (1,640)
33.1

$$$$
WAY-298760
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,641)
1641

>  <Formula> (1,641)
C15H13F3N4OS

>  <MolWeight> (1,641)
354.3501296

>  <PCAT_CMPD_ID> (1,641)
WAY-298760

>  <CNC_ID> (1,641)
359357754

>  <transfer_container_id> (1,641)
PTN000000069

>  <COMPOUND_NUMBER> (1,641)
WAY-298760

>  <BAR_CODE_NO> (1,641)
3900329

>  <LOCATION_CODE> (1,641)
PTNCS

>  <AMOUNT_CURRENT> (1,641)
33.2

$$$$
WAY-298767
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,642)
1642

>  <Formula> (1,642)
C19H15FN2O5S

>  <MolWeight> (1,642)
402.3962032

>  <PCAT_CMPD_ID> (1,642)
WAY-298767

>  <CNC_ID> (1,642)
359357761

>  <transfer_container_id> (1,642)
PTN000000069

>  <COMPOUND_NUMBER> (1,642)
WAY-298767

>  <BAR_CODE_NO> (1,642)
3900338

>  <LOCATION_CODE> (1,642)
PTNCS

>  <AMOUNT_CURRENT> (1,642)
33.3

$$$$
WAY-298784
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,643)
1643

>  <Formula> (1,643)
C18H13BrClF3N4O2

>  <MolWeight> (1,643)
489.6736296

>  <PCAT_CMPD_ID> (1,643)
WAY-298784

>  <CNC_ID> (1,643)
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>  <transfer_container_id> (1,643)
PTN000000069

>  <COMPOUND_NUMBER> (1,643)
WAY-298784

>  <BAR_CODE_NO> (1,643)
3900356

>  <LOCATION_CODE> (1,643)
PTNCS

>  <AMOUNT_CURRENT> (1,643)
33.4

$$$$
WAY-298788
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 14  2  1  0  0  0  0
 15  2  1  0  0  0  0
 16  2  1  0  0  0  0
 17  5  2  0  0  0  0
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 17 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,644)
1644

>  <Formula> (1,644)
C14H14F3N5

>  <MolWeight> (1,644)
309.2896696

>  <PCAT_CMPD_ID> (1,644)
WAY-298788

>  <CNC_ID> (1,644)
359357782

>  <transfer_container_id> (1,644)
PTN000000069

>  <COMPOUND_NUMBER> (1,644)
WAY-298788

>  <BAR_CODE_NO> (1,644)
3900362

>  <LOCATION_CODE> (1,644)
PTNCS

>  <AMOUNT_CURRENT> (1,644)
33.3

$$$$
WAY-298809
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 19 20  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,645)
1645

>  <Formula> (1,645)
C15H15NO6S

>  <MolWeight> (1,645)
337.3477

>  <PCAT_CMPD_ID> (1,645)
WAY-298809

>  <CNC_ID> (1,645)
359357803

>  <transfer_container_id> (1,645)
PTN000000069

>  <COMPOUND_NUMBER> (1,645)
WAY-298809

>  <BAR_CODE_NO> (1,645)
3900387

>  <LOCATION_CODE> (1,645)
PTNCS

>  <AMOUNT_CURRENT> (1,645)
33.3

$$$$
WAY-298811-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,646)
1646

>  <Formula> (1,646)
C20H23N5

>  <MolWeight> (1,646)
333.43012

>  <PCAT_CMPD_ID> (1,646)
WAY-298811-A

>  <CNC_ID> (1,646)
359357805

>  <transfer_container_id> (1,646)
PTN000000069

>  <COMPOUND_NUMBER> (1,646)
WAY-298811-A

>  <BAR_CODE_NO> (1,646)
3900390

>  <LOCATION_CODE> (1,646)
PTNCS

>  <AMOUNT_CURRENT> (1,646)
33.2

$$$$
WAY-298813
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,647)
1647

>  <Formula> (1,647)
C15H19N3OS

>  <MolWeight> (1,647)
289.39586

>  <PCAT_CMPD_ID> (1,647)
WAY-298813

>  <CNC_ID> (1,647)
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>  <transfer_container_id> (1,647)
PTN000000069

>  <COMPOUND_NUMBER> (1,647)
WAY-298813

>  <BAR_CODE_NO> (1,647)
3900392

>  <LOCATION_CODE> (1,647)
PTNCS

>  <AMOUNT_CURRENT> (1,647)
33.2

$$$$
WAY-298829
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,648)
1648

>  <Formula> (1,648)
C18H21N5O3

>  <MolWeight> (1,648)
355.39104

>  <PCAT_CMPD_ID> (1,648)
WAY-298829

>  <CNC_ID> (1,648)
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>  <transfer_container_id> (1,648)
PTN000000069

>  <COMPOUND_NUMBER> (1,648)
WAY-298829

>  <BAR_CODE_NO> (1,648)
3900413

>  <LOCATION_CODE> (1,648)
PTNCS

>  <AMOUNT_CURRENT> (1,648)
33.2

$$$$
WAY-298835
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,649)
1649

>  <Formula> (1,649)
C15H13ClN2O

>  <MolWeight> (1,649)
272.72952

>  <PCAT_CMPD_ID> (1,649)
WAY-298835

>  <CNC_ID> (1,649)
359357829

>  <transfer_container_id> (1,649)
PTN000000069

>  <COMPOUND_NUMBER> (1,649)
WAY-298835

>  <BAR_CODE_NO> (1,649)
3900421

>  <LOCATION_CODE> (1,649)
PTNCS

>  <AMOUNT_CURRENT> (1,649)
33

$$$$
WAY-298838
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,650)
1650

>  <Formula> (1,650)
C14H16F3N3O2

>  <MolWeight> (1,650)
315.2909496

>  <PCAT_CMPD_ID> (1,650)
WAY-298838

>  <CNC_ID> (1,650)
359357832

>  <transfer_container_id> (1,650)
PTN000000069

>  <COMPOUND_NUMBER> (1,650)
WAY-298838

>  <BAR_CODE_NO> (1,650)
3900428

>  <LOCATION_CODE> (1,650)
PTNCS

>  <AMOUNT_CURRENT> (1,650)
33.3

$$$$
WAY-298842
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,651)
1651

>  <Formula> (1,651)
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>  <MolWeight> (1,651)
265.3098

>  <PCAT_CMPD_ID> (1,651)
WAY-298842

>  <CNC_ID> (1,651)
359357836

>  <transfer_container_id> (1,651)
PTN000000069

>  <COMPOUND_NUMBER> (1,651)
WAY-298842

>  <BAR_CODE_NO> (1,651)
3900436

>  <LOCATION_CODE> (1,651)
PTNCS

>  <AMOUNT_CURRENT> (1,651)
33.4

$$$$
WAY-298965
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,652)
1652

>  <Formula> (1,652)
C23H20N4O3

>  <MolWeight> (1,652)
400.4299

>  <PCAT_CMPD_ID> (1,652)
WAY-298965

>  <CNC_ID> (1,652)
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>  <transfer_container_id> (1,652)
PTN000000069

>  <COMPOUND_NUMBER> (1,652)
WAY-298965

>  <BAR_CODE_NO> (1,652)
3900603

>  <LOCATION_CODE> (1,652)
PTNCS

>  <AMOUNT_CURRENT> (1,652)
33.2

$$$$
WAY-299063
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,653)
1653

>  <Formula> (1,653)
C17H14N4O4S

>  <MolWeight> (1,653)
370.38246

>  <PCAT_CMPD_ID> (1,653)
WAY-299063

>  <CNC_ID> (1,653)
359358057

>  <transfer_container_id> (1,653)
PTN000000069

>  <COMPOUND_NUMBER> (1,653)
WAY-299063

>  <BAR_CODE_NO> (1,653)
3900736

>  <LOCATION_CODE> (1,653)
PTNCS

>  <AMOUNT_CURRENT> (1,653)
33.2

$$$$
WAY-299067
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  6  8  2  0  0  0  0
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 16 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,654)
1654

>  <Formula> (1,654)
C18H13BrN4O

>  <MolWeight> (1,654)
381.22602

>  <PCAT_CMPD_ID> (1,654)
WAY-299067

>  <CNC_ID> (1,654)
359358061

>  <transfer_container_id> (1,654)
PTN000000069

>  <COMPOUND_NUMBER> (1,654)
WAY-299067

>  <BAR_CODE_NO> (1,654)
3900740

>  <LOCATION_CODE> (1,654)
PTNCS

>  <AMOUNT_CURRENT> (1,654)
33.2

$$$$
WAY-299073
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,655)
1655

>  <Formula> (1,655)
C18H18N6O2

>  <MolWeight> (1,655)
350.37452

>  <PCAT_CMPD_ID> (1,655)
WAY-299073

>  <CNC_ID> (1,655)
359358067

>  <transfer_container_id> (1,655)
PTN000000069

>  <COMPOUND_NUMBER> (1,655)
WAY-299073

>  <BAR_CODE_NO> (1,655)
3900749

>  <LOCATION_CODE> (1,655)
PTNCS

>  <AMOUNT_CURRENT> (1,655)
33.3

$$$$
WAY-299090-A
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,656)
1656

>  <Formula> (1,656)
C18H35NO2

>  <MolWeight> (1,656)
297.476

>  <PCAT_CMPD_ID> (1,656)
WAY-299090-A

>  <CNC_ID> (1,656)
359358084

>  <transfer_container_id> (1,656)
PTN000000069

>  <COMPOUND_NUMBER> (1,656)
WAY-299090-A

>  <BAR_CODE_NO> (1,656)
3900768

>  <LOCATION_CODE> (1,656)
PTNCS

>  <AMOUNT_CURRENT> (1,656)
33.2

$$$$
WAY-299248
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,657)
1657

>  <Formula> (1,657)
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>  <CNC_ID> (1,657)
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>  <transfer_container_id> (1,657)
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WAY-299248

>  <BAR_CODE_NO> (1,657)
3900984

>  <LOCATION_CODE> (1,657)
PTNCS

>  <AMOUNT_CURRENT> (1,657)
33.1

$$$$
WAY-299315
csChFnd80/10111816222D

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>  <Mol_ID> (1,658)
1658

>  <Formula> (1,658)
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468.2703896

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>  <COMPOUND_NUMBER> (1,658)
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>  <BAR_CODE_NO> (1,658)
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>  <LOCATION_CODE> (1,658)
PTNCS

>  <AMOUNT_CURRENT> (1,658)
33.2

$$$$
WAY-299338
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,659)
1659

>  <Formula> (1,659)
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>  <MolWeight> (1,659)
328.38554

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>  <CNC_ID> (1,659)
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>  <BAR_CODE_NO> (1,659)
3901099

>  <LOCATION_CODE> (1,659)
PTNCS

>  <AMOUNT_CURRENT> (1,659)
33.3

$$$$
WAY-299347
csChFnd80/10111816222D

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>  <Mol_ID> (1,660)
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>  <Formula> (1,660)
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>  <MolWeight> (1,660)
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>  <PCAT_CMPD_ID> (1,660)
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>  <CNC_ID> (1,660)
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>  <transfer_container_id> (1,660)
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>  <COMPOUND_NUMBER> (1,660)
WAY-299347

>  <BAR_CODE_NO> (1,660)
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>  <LOCATION_CODE> (1,660)
PTNCS

>  <AMOUNT_CURRENT> (1,660)
33.2

$$$$
WAY-299360
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,661)
1661

>  <Formula> (1,661)
C18H18N2O2S

>  <MolWeight> (1,661)
326.41272

>  <PCAT_CMPD_ID> (1,661)
WAY-299360

>  <CNC_ID> (1,661)
359358354

>  <transfer_container_id> (1,661)
PTN000000069

>  <COMPOUND_NUMBER> (1,661)
WAY-299360

>  <BAR_CODE_NO> (1,661)
3901127

>  <LOCATION_CODE> (1,661)
PTNCS

>  <AMOUNT_CURRENT> (1,661)
33.3

$$$$
WAY-299413
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,662)
1662

>  <Formula> (1,662)
C15H15ClN2OS

>  <MolWeight> (1,662)
306.8104

>  <PCAT_CMPD_ID> (1,662)
WAY-299413

>  <CNC_ID> (1,662)
359358407

>  <transfer_container_id> (1,662)
PTN000000069

>  <COMPOUND_NUMBER> (1,662)
WAY-299413

>  <BAR_CODE_NO> (1,662)
3901200

>  <LOCATION_CODE> (1,662)
PTNCS

>  <AMOUNT_CURRENT> (1,662)
33

$$$$
WAY-299461
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
 13 19  1  0  0  0  0
 11 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,663)
1663

>  <Formula> (1,663)
C17H22N2O2

>  <MolWeight> (1,663)
286.36878

>  <PCAT_CMPD_ID> (1,663)
WAY-299461

>  <CNC_ID> (1,663)
359358455

>  <transfer_container_id> (1,663)
PTN000000069

>  <COMPOUND_NUMBER> (1,663)
WAY-299461

>  <BAR_CODE_NO> (1,663)
3901259

>  <LOCATION_CODE> (1,663)
PTNCS

>  <AMOUNT_CURRENT> (1,663)
33.4

$$$$
WAY-389270
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 15  5  1  0  0  0  0
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 25 23  1  0  0  0  0
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M  END
>  <Mol_ID> (1,664)
1664

>  <Formula> (1,664)
C19H24N4S2

>  <MolWeight> (1,664)
372.55066

>  <PCAT_CMPD_ID> (1,664)
WAY-389270

>  <CNC_ID> (1,664)
359373395

>  <transfer_container_id> (1,664)
PTN000000070

>  <COMPOUND_NUMBER> (1,664)
WAY-389270

>  <BAR_CODE_NO> (1,664)
2541839

>  <LOCATION_CODE> (1,664)
PTNCS

>  <AMOUNT_CURRENT> (1,664)
28.9

$$$$
WAY-389273
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 18  3  1  0  0  0  0
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 21  4  2  0  0  0  0
 22  5  2  0  0  0  0
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 15 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,665)
1665

>  <Formula> (1,665)
C17H16N4O2S

>  <MolWeight> (1,665)
340.39954

>  <PCAT_CMPD_ID> (1,665)
WAY-389273

>  <CNC_ID> (1,665)
359373398

>  <transfer_container_id> (1,665)
PTN000000070

>  <COMPOUND_NUMBER> (1,665)
WAY-389273

>  <BAR_CODE_NO> (1,665)
2541842

>  <LOCATION_CODE> (1,665)
PTNCS

>  <AMOUNT_CURRENT> (1,665)
32.2

$$$$
WAY-389286
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 13  6  1  0  0  0  0
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 15 13  1  0  0  0  0
 16  4  2  0  0  0  0
 17 25  1  0  0  0  0
 18 10  1  0  0  0  0
 19  8  1  0  0  0  0
 20 11  1  0  0  0  0
 21  7  1  0  0  0  0
 22  7  1  0  0  0  0
 23  9  2  0  0  0  0
 24 12  2  0  0  0  0
 25 22  1  0  0  0  0
 26 21  1  0  0  0  0
 27 20  1  0  0  0  0
 28 19  1  0  0  0  0
 29 27  1  0  0  0  0
 30 24  1  0  0  0  0
 31 23  1  0  0  0  0
 12  9  1  0  0  0  0
  8 10  2  0  0  0  0
 17 26  1  0  0  0  0
 30 31  2  0  0  0  0
M  END
>  <Mol_ID> (1,666)
1666

>  <Formula> (1,666)
C23H24ClN3O4

>  <MolWeight> (1,666)
441.90736

>  <PCAT_CMPD_ID> (1,666)
WAY-389286

>  <CNC_ID> (1,666)
359373411

>  <transfer_container_id> (1,666)
PTN000000070

>  <COMPOUND_NUMBER> (1,666)
WAY-389286

>  <BAR_CODE_NO> (1,666)
2541856

>  <LOCATION_CODE> (1,666)
PTNCS

>  <AMOUNT_CURRENT> (1,666)
32.6

$$$$
WAY-389300
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.7875   -5.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8250   -3.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 15  1  0  0  0  0
 10  4  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  6  2  0  0  0  0
 14  9  2  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18  6  1  0  0  0  0
 19 13  1  0  0  0  0
 20 21  2  0  0  0  0
 21 12  1  0  0  0  0
 22 11  2  0  0  0  0
 23 13  1  0  0  0  0
 24 19  1  0  0  0  0
 25 18  2  0  0  0  0
 26 25  1  0  0  0  0
  4  5  2  0  0  0  0
 23 26  2  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,667)
1667

>  <Formula> (1,667)
C17H13Cl2N3O3S

>  <MolWeight> (1,667)
410.27442

>  <PCAT_CMPD_ID> (1,667)
WAY-389300

>  <CNC_ID> (1,667)
359373425

>  <transfer_container_id> (1,667)
PTN000000070

>  <COMPOUND_NUMBER> (1,667)
WAY-389300

>  <BAR_CODE_NO> (1,667)
2541872

>  <LOCATION_CODE> (1,667)
PTNCS

>  <AMOUNT_CURRENT> (1,667)
32.8

$$$$
WAY-389311
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    9.1542   -4.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4792   -3.5667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2875   -4.4917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.0167   -5.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6042   -6.4667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6000   -4.4417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8417   -5.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8292   -6.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7250   -6.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4292   -9.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2917   -7.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.3042    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.9750   -8.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4500   -5.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4500   -3.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7 10  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  2  0  0  0  0
 10  6  1  0  0  0  0
 11  3  1  0  0  0  0
 12  8  1  0  0  0  0
 13 17  2  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20  4  2  0  0  0  0
 21  5  2  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
  5  4  1  0  0  0  0
 23 22  2  0  0  0  0
 16 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,668)
1668

>  <Formula> (1,668)
C17H16FN3OS

>  <MolWeight> (1,668)
329.3918432

>  <PCAT_CMPD_ID> (1,668)
WAY-389311

>  <CNC_ID> (1,668)
359373436

>  <transfer_container_id> (1,668)
PTN000000070

>  <COMPOUND_NUMBER> (1,668)
WAY-389311

>  <BAR_CODE_NO> (1,668)
2541883

>  <LOCATION_CODE> (1,668)
PTNCS

>  <AMOUNT_CURRENT> (1,668)
32.3

$$$$
WAY-389313
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    8.5792   -4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9417   -3.7667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6750   -4.6625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.2042   -5.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0417   -3.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3042   -5.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9792   -6.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.2792   -7.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3292   -1.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10 11  1  0  0  0  0
 11 17  1  0  0  0  0
 12  8  1  0  0  0  0
 13  5  2  0  0  0  0
 14 10  2  0  0  0  0
 15  9  1  0  0  0  0
 16  9  2  0  0  0  0
 17 18  2  0  0  0  0
 18 16  1  0  0  0  0
 19 15  2  0  0  0  0
 20 12  2  0  0  0  0
 21 10  1  0  0  0  0
 22  8  2  0  0  0  0
 23 24  2  0  0  0  0
 24 22  1  0  0  0  0
  7  3  2  0  0  0  0
 17 19  1  0  0  0  0
 23 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,669)
1669

>  <Formula> (1,669)
C17H14N4O2S

>  <MolWeight> (1,669)
338.38366

>  <PCAT_CMPD_ID> (1,669)
WAY-389313

>  <CNC_ID> (1,669)
359373438

>  <transfer_container_id> (1,669)
PTN000000070

>  <COMPOUND_NUMBER> (1,669)
WAY-389313

>  <BAR_CODE_NO> (1,669)
2541886

>  <LOCATION_CODE> (1,669)
PTNCS

>  <AMOUNT_CURRENT> (1,669)
32.1

$$$$
WAY-389357
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.6250   -5.0542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3417   -2.9542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4000   -5.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7542   -4.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2167   -3.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9750   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.3375   -7.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1042   -7.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4667   -6.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.9917    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
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    4.9625   -5.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8 10  2  0  0  0  0
  9  8  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  4  1  0  0  0  0
 13  5  2  0  0  0  0
 14  4  2  0  0  0  0
 15 10  1  0  0  0  0
 16 18  1  0  0  0  0
 17  8  1  0  0  0  0
 18 15  2  0  0  0  0
 19 16  1  0  0  0  0
 20  3  2  0  0  0  0
 21  6  2  0  0  0  0
 22 20  1  0  0  0  0
 23 22  2  0  0  0  0
  6  2  1  0  0  0  0
 21 23  1  0  0  0  0
 16  9  2  0  0  0  0
M  END
>  <Mol_ID> (1,670)
1670

>  <Formula> (1,670)
C16H12BrFN2O3

>  <MolWeight> (1,670)
379.1804832

>  <PCAT_CMPD_ID> (1,670)
WAY-389357

>  <CNC_ID> (1,670)
359373481

>  <transfer_container_id> (1,670)
PTN000000070

>  <COMPOUND_NUMBER> (1,670)
WAY-389357

>  <BAR_CODE_NO> (1,670)
2541933

>  <LOCATION_CODE> (1,670)
PTNCS

>  <AMOUNT_CURRENT> (1,670)
32.3

$$$$
WAY-389360
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
    9.6917   -4.8542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5792   -5.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2250   -6.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4875   -6.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4917   -4.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3292   -5.9292    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.0917   -5.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1292   -8.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1917   -4.8167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3875   -5.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8792   -3.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3875   -8.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3500   -5.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (1,671)
1671

>  <Formula> (1,671)
C23H23ClN2O2

>  <MolWeight> (1,671)
394.89392

>  <PCAT_CMPD_ID> (1,671)
WAY-389360

>  <CNC_ID> (1,671)
359373484

>  <transfer_container_id> (1,671)
PTN000000070

>  <COMPOUND_NUMBER> (1,671)
WAY-389360

>  <BAR_CODE_NO> (1,671)
2541937

>  <LOCATION_CODE> (1,671)
PTNCS

>  <AMOUNT_CURRENT> (1,671)
32.4

$$$$
WAY-389676
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,672)
1672

>  <Formula> (1,672)
C18H21N3OS2

>  <MolWeight> (1,672)
359.50884

>  <PCAT_CMPD_ID> (1,672)
WAY-389676

>  <CNC_ID> (1,672)
359373794

>  <transfer_container_id> (1,672)
PTN000000070

>  <COMPOUND_NUMBER> (1,672)
WAY-389676

>  <BAR_CODE_NO> (1,672)
2542274

>  <LOCATION_CODE> (1,672)
PTNCS

>  <AMOUNT_CURRENT> (1,672)
32.5

$$$$
WAY-389399
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,673)
1673

>  <Formula> (1,673)
C21H23N3O6S

>  <MolWeight> (1,673)
445.48882

>  <PCAT_CMPD_ID> (1,673)
WAY-389399

>  <CNC_ID> (1,673)
359373523

>  <transfer_container_id> (1,673)
PTN000000070

>  <COMPOUND_NUMBER> (1,673)
WAY-389399

>  <BAR_CODE_NO> (1,673)
2542015

>  <LOCATION_CODE> (1,673)
PTNCS

>  <AMOUNT_CURRENT> (1,673)
32.3

$$$$
WAY-389408
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,674)
1674

>  <Formula> (1,674)
C17H21N3O6S

>  <MolWeight> (1,674)
395.43014

>  <PCAT_CMPD_ID> (1,674)
WAY-389408

>  <CNC_ID> (1,674)
359373532

>  <transfer_container_id> (1,674)
PTN000000070

>  <COMPOUND_NUMBER> (1,674)
WAY-389408

>  <BAR_CODE_NO> (1,674)
2541977

>  <LOCATION_CODE> (1,674)
PTNCS

>  <AMOUNT_CURRENT> (1,674)
32.8

$$$$
WAY-389412
csChFnd80/10111816222D

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 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,675)
1675

>  <Formula> (1,675)
C20H20ClNO5S

>  <MolWeight> (1,675)
421.8945

>  <PCAT_CMPD_ID> (1,675)
WAY-389412

>  <CNC_ID> (1,675)
359373538

>  <transfer_container_id> (1,675)
PTN000000070

>  <COMPOUND_NUMBER> (1,675)
WAY-389412

>  <BAR_CODE_NO> (1,675)
2541982

>  <LOCATION_CODE> (1,675)
PTNCS

>  <AMOUNT_CURRENT> (1,675)
32.8

$$$$
WAY-389465
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11  4  1  0  0  0  0
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 18  6  1  0  0  0  0
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 21  9  1  0  0  0  0
 22 16  1  0  0  0  0
 23 14  1  0  0  0  0
 24 22  1  0  0  0  0
  5  3  1  0  0  0  0
  6  8  2  0  0  0  0
 17 12  1  0  0  0  0
M  END
>  <Mol_ID> (1,676)
1676

>  <Formula> (1,676)
C16H13Cl2N3O2S

>  <MolWeight> (1,676)
382.26432

>  <PCAT_CMPD_ID> (1,676)
WAY-389465

>  <CNC_ID> (1,676)
359373590

>  <transfer_container_id> (1,676)
PTN000000070

>  <COMPOUND_NUMBER> (1,676)
WAY-389465

>  <BAR_CODE_NO> (1,676)
2542045

>  <LOCATION_CODE> (1,676)
PTNCS

>  <AMOUNT_CURRENT> (1,676)
32.6

$$$$
WAY-389469
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  9  2  0  0  0  0
  6  2  2  0  0  0  0
  7  1  2  0  0  0  0
  8  4  1  0  0  0  0
  9  2  1  0  0  0  0
 10  6  1  0  0  0  0
 11 10  1  0  0  0  0
 12  5  1  0  0  0  0
 13  4  1  0  0  0  0
 14  8  1  0  0  0  0
 15  8  1  0  0  0  0
 16 13  1  0  0  0  0
 17 16  1  0  0  0  0
 10 12  2  0  0  0  0
 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,677)
1677

>  <Formula> (1,677)
C13H17BrN2O

>  <MolWeight> (1,677)
297.19088

>  <PCAT_CMPD_ID> (1,677)
WAY-389469

>  <CNC_ID> (1,677)
359373594

>  <transfer_container_id> (1,677)
PTN000000070

>  <COMPOUND_NUMBER> (1,677)
WAY-389469

>  <BAR_CODE_NO> (1,677)
2542033

>  <LOCATION_CODE> (1,677)
PTNCS

>  <AMOUNT_CURRENT> (1,677)
32.1

$$$$
WAY-389491
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
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 15  9  1  0  0  0  0
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 18  7  1  0  0  0  0
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 23 20  2  0  0  0  0
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 25 23  1  0  0  0  0
  7  4  2  0  0  0  0
 11 15  1  0  0  0  0
 25 24  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,678)
1678

>  <Formula> (1,678)
C20H20N4O

>  <MolWeight> (1,678)
332.399

>  <PCAT_CMPD_ID> (1,678)
WAY-389491

>  <CNC_ID> (1,678)
359373616

>  <transfer_container_id> (1,678)
PTN000000070

>  <COMPOUND_NUMBER> (1,678)
WAY-389491

>  <BAR_CODE_NO> (1,678)
2542076

>  <LOCATION_CODE> (1,678)
PTNCS

>  <AMOUNT_CURRENT> (1,678)
32.2

$$$$
WAY-389492
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 14  2  1  0  0  0  0
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 22  6  1  0  0  0  0
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M  END
>  <Mol_ID> (1,679)
1679

>  <Formula> (1,679)
C16H18N4O2S2

>  <MolWeight> (1,679)
362.46972

>  <PCAT_CMPD_ID> (1,679)
WAY-389492

>  <CNC_ID> (1,679)
359373617

>  <transfer_container_id> (1,679)
PTN000000070

>  <COMPOUND_NUMBER> (1,679)
WAY-389492

>  <BAR_CODE_NO> (1,679)
2542103

>  <LOCATION_CODE> (1,679)
PTNCS

>  <AMOUNT_CURRENT> (1,679)
32.6

$$$$
WAY-389528
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
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M  END
>  <Mol_ID> (1,680)
1680

>  <Formula> (1,680)
C22H22N4O4

>  <MolWeight> (1,680)
406.43448

>  <PCAT_CMPD_ID> (1,680)
WAY-389528

>  <CNC_ID> (1,680)
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>  <transfer_container_id> (1,680)
PTN000000070

>  <COMPOUND_NUMBER> (1,680)
WAY-389528

>  <BAR_CODE_NO> (1,680)
2542115

>  <LOCATION_CODE> (1,680)
PTNCS

>  <AMOUNT_CURRENT> (1,680)
32

$$$$
WAY-389535
csChFnd80/10111816222D

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 11  9  1  0  0  0  0
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 15  8  1  0  0  0  0
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  2  3  1  0  0  0  0
 11 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,681)
1681

>  <Formula> (1,681)
C16H18N2O6

>  <MolWeight> (1,681)
334.32392

>  <PCAT_CMPD_ID> (1,681)
WAY-389535

>  <CNC_ID> (1,681)
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>  <transfer_container_id> (1,681)
PTN000000070

>  <COMPOUND_NUMBER> (1,681)
WAY-389535

>  <BAR_CODE_NO> (1,681)
2542120

>  <LOCATION_CODE> (1,681)
PTNCS

>  <AMOUNT_CURRENT> (1,681)
32.4

$$$$
WAY-389562
csChFnd80/10111816222D

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 13  7  1  0  0  0  0
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 15  5  2  0  0  0  0
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 13  9  2  0  0  0  0
  4  6  2  0  0  0  0
M  END
>  <Mol_ID> (1,682)
1682

>  <Formula> (1,682)
C14H11Cl2NO3

>  <MolWeight> (1,682)
312.14804

>  <PCAT_CMPD_ID> (1,682)
WAY-389562

>  <CNC_ID> (1,682)
359373684

>  <transfer_container_id> (1,682)
PTN000000070

>  <COMPOUND_NUMBER> (1,682)
WAY-389562

>  <BAR_CODE_NO> (1,682)
2542152

>  <LOCATION_CODE> (1,682)
PTNCS

>  <AMOUNT_CURRENT> (1,682)
32.3

$$$$
WAY-389591
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  4  6  1  0  0  0  0
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M  END
>  <Mol_ID> (1,683)
1683

>  <Formula> (1,683)
C17H21N3OS

>  <MolWeight> (1,683)
315.43314

>  <PCAT_CMPD_ID> (1,683)
WAY-389591

>  <CNC_ID> (1,683)
359373713

>  <transfer_container_id> (1,683)
PTN000000070

>  <COMPOUND_NUMBER> (1,683)
WAY-389591

>  <BAR_CODE_NO> (1,683)
2542173

>  <LOCATION_CODE> (1,683)
PTNCS

>  <AMOUNT_CURRENT> (1,683)
32.2

$$$$
WAY-389636
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 13  3  2  0  0  0  0
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 14 10  1  0  0  0  0
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M  END
>  <Mol_ID> (1,684)
1684

>  <Formula> (1,684)
C22H23N3O5S

>  <MolWeight> (1,684)
441.50012

>  <PCAT_CMPD_ID> (1,684)
WAY-389636

>  <CNC_ID> (1,684)
359373755

>  <transfer_container_id> (1,684)
PTN000000070

>  <COMPOUND_NUMBER> (1,684)
WAY-389636

>  <BAR_CODE_NO> (1,684)
2542217

>  <LOCATION_CODE> (1,684)
PTNCS

>  <AMOUNT_CURRENT> (1,684)
32.3

$$$$
WAY-389641
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,685)
1685

>  <Formula> (1,685)
C17H19ClN2O3S2

>  <MolWeight> (1,685)
398.92736

>  <PCAT_CMPD_ID> (1,685)
WAY-389641

>  <CNC_ID> (1,685)
359373759

>  <transfer_container_id> (1,685)
PTN000000070

>  <COMPOUND_NUMBER> (1,685)
WAY-389641

>  <BAR_CODE_NO> (1,685)
2542222

>  <LOCATION_CODE> (1,685)
PTNCS

>  <AMOUNT_CURRENT> (1,685)
32.7

$$$$
WAY-389660
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,686)
1686

>  <Formula> (1,686)
C24H24N2O2

>  <MolWeight> (1,686)
372.45956

>  <PCAT_CMPD_ID> (1,686)
WAY-389660

>  <CNC_ID> (1,686)
359373778

>  <transfer_container_id> (1,686)
PTN000000070

>  <COMPOUND_NUMBER> (1,686)
WAY-389660

>  <BAR_CODE_NO> (1,686)
2542254

>  <LOCATION_CODE> (1,686)
PTNCS

>  <AMOUNT_CURRENT> (1,686)
32.7

$$$$
WAY-389761
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  8  2  0  0  0  0
 14  5  1  0  0  0  0
 15 10  1  0  0  0  0
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 21  7  1  0  0  0  0
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 17 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,687)
1687

>  <Formula> (1,687)
C19H17N3O3S

>  <MolWeight> (1,687)
367.42158

>  <PCAT_CMPD_ID> (1,687)
WAY-389761

>  <CNC_ID> (1,687)
359373877

>  <transfer_container_id> (1,687)
PTN000000070

>  <COMPOUND_NUMBER> (1,687)
WAY-389761

>  <BAR_CODE_NO> (1,687)
2542339

>  <LOCATION_CODE> (1,687)
PTNCS

>  <AMOUNT_CURRENT> (1,687)
32.2

$$$$
WAY-389852
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
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 14  4  2  0  0  0  0
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 18  6  2  0  0  0  0
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M  END
>  <Mol_ID> (1,688)
1688

>  <Formula> (1,688)
C17H13F2N3O3

>  <MolWeight> (1,688)
345.3002264

>  <PCAT_CMPD_ID> (1,688)
WAY-389852

>  <CNC_ID> (1,688)
359373961

>  <transfer_container_id> (1,688)
PTN000000070

>  <COMPOUND_NUMBER> (1,688)
WAY-389852

>  <BAR_CODE_NO> (1,688)
2542451

>  <LOCATION_CODE> (1,688)
PTNCS

>  <AMOUNT_CURRENT> (1,688)
32.9

$$$$
WAY-389891
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,689)
1689

>  <Formula> (1,689)
C22H23ClFN3O3

>  <MolWeight> (1,689)
431.8877232

>  <PCAT_CMPD_ID> (1,689)
WAY-389891

>  <CNC_ID> (1,689)
359374000

>  <transfer_container_id> (1,689)
PTN000000070

>  <COMPOUND_NUMBER> (1,689)
WAY-389891

>  <BAR_CODE_NO> (1,689)
2542501

>  <LOCATION_CODE> (1,689)
PTNCS

>  <AMOUNT_CURRENT> (1,689)
32.2

$$$$
WAY-389898
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,690)
1690

>  <Formula> (1,690)
C14H11N3O2S2

>  <MolWeight> (1,690)
317.38604

>  <PCAT_CMPD_ID> (1,690)
WAY-389898

>  <CNC_ID> (1,690)
359374007

>  <transfer_container_id> (1,690)
PTN000000070

>  <COMPOUND_NUMBER> (1,690)
WAY-389898

>  <BAR_CODE_NO> (1,690)
2542479

>  <LOCATION_CODE> (1,690)
PTNCS

>  <AMOUNT_CURRENT> (1,690)
32.2

$$$$
WAY-389920
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,691)
1691

>  <Formula> (1,691)
C18H21N3O3S

>  <MolWeight> (1,691)
359.44264

>  <PCAT_CMPD_ID> (1,691)
WAY-389920

>  <CNC_ID> (1,691)
359374029

>  <transfer_container_id> (1,691)
PTN000000070

>  <COMPOUND_NUMBER> (1,691)
WAY-389920

>  <BAR_CODE_NO> (1,691)
2542524

>  <LOCATION_CODE> (1,691)
PTNCS

>  <AMOUNT_CURRENT> (1,691)
32.5

$$$$
WAY-390036
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,692)
1692

>  <Formula> (1,692)
C11H13N3O2S2

>  <MolWeight> (1,692)
283.36982

>  <PCAT_CMPD_ID> (1,692)
WAY-390036

>  <CNC_ID> (1,692)
359374142

>  <transfer_container_id> (1,692)
PTN000000070

>  <COMPOUND_NUMBER> (1,692)
WAY-390036

>  <BAR_CODE_NO> (1,692)
2542627

>  <LOCATION_CODE> (1,692)
PTNCS

>  <AMOUNT_CURRENT> (1,692)
32.7

$$$$
CL-282694
csChFnd80/10111816222D

 22 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,693)
1693

>  <Formula> (1,693)
C20H14O2

>  <MolWeight> (1,693)
286.32396

>  <PCAT_CMPD_ID> (1,693)
CL-282694

>  <CNC_ID> (1,693)
359380523

>  <transfer_container_id> (1,693)
PTN000000071

>  <COMPOUND_NUMBER> (1,693)
CL-282694

>  <BAR_CODE_NO> (1,693)
3904573

>  <LOCATION_CODE> (1,693)
PTNCS

>  <AMOUNT_CURRENT> (1,693)
33.4

$$$$
CL-292483
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,694)
1694

>  <Formula> (1,694)
C16H13NO2

>  <MolWeight> (1,694)
251.27992

>  <PCAT_CMPD_ID> (1,694)
CL-292483

>  <CNC_ID> (1,694)
359380525

>  <transfer_container_id> (1,694)
PTN000000071

>  <COMPOUND_NUMBER> (1,694)
CL-292483

>  <BAR_CODE_NO> (1,694)
3904249

>  <LOCATION_CODE> (1,694)
PTNCS

>  <AMOUNT_CURRENT> (1,694)
33.3

$$$$
CL-402353
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,695)
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>  <Formula> (1,695)
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>  <CNC_ID> (1,695)
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>  <transfer_container_id> (1,695)
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>  <COMPOUND_NUMBER> (1,695)
CL-402353

>  <BAR_CODE_NO> (1,695)
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>  <LOCATION_CODE> (1,695)
PTNCS

>  <AMOUNT_CURRENT> (1,695)
33

$$$$
CL-406921
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,696)
1696

>  <Formula> (1,696)
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>  <MolWeight> (1,696)
214.22

>  <PCAT_CMPD_ID> (1,696)
CL-406921

>  <CNC_ID> (1,696)
359380551

>  <transfer_container_id> (1,696)
PTN000000071

>  <COMPOUND_NUMBER> (1,696)
CL-406921

>  <BAR_CODE_NO> (1,696)
3905946

>  <LOCATION_CODE> (1,696)
PTNCS

>  <AMOUNT_CURRENT> (1,696)
33.2

$$$$
CL-409386
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,697)
1697

>  <Formula> (1,697)
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>  <MolWeight> (1,697)
352.3838

>  <PCAT_CMPD_ID> (1,697)
CL-409386

>  <CNC_ID> (1,697)
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>  <COMPOUND_NUMBER> (1,697)
CL-409386

>  <BAR_CODE_NO> (1,697)
3904538

>  <LOCATION_CODE> (1,697)
PTNCS

>  <AMOUNT_CURRENT> (1,697)
33.1

$$$$
CL-409767
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,698)
1698

>  <Formula> (1,698)
C15H12N4O

>  <MolWeight> (1,698)
264.28198

>  <PCAT_CMPD_ID> (1,698)
CL-409767

>  <CNC_ID> (1,698)
359380554

>  <transfer_container_id> (1,698)
PTN000000071

>  <COMPOUND_NUMBER> (1,698)
CL-409767

>  <BAR_CODE_NO> (1,698)
3904484

>  <LOCATION_CODE> (1,698)
PTNCS

>  <AMOUNT_CURRENT> (1,698)
33.3

$$$$
CL-416818
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,699)
1699

>  <Formula> (1,699)
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>  <MolWeight> (1,699)
383.48396

>  <PCAT_CMPD_ID> (1,699)
CL-416818

>  <CNC_ID> (1,699)
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>  <transfer_container_id> (1,699)
PTN000000071

>  <COMPOUND_NUMBER> (1,699)
CL-416818

>  <BAR_CODE_NO> (1,699)
3905373

>  <LOCATION_CODE> (1,699)
PTNCS

>  <AMOUNT_CURRENT> (1,699)
33.3

$$$$
CL-419631
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,700)
1700

>  <Formula> (1,700)
C13H7ClO3

>  <MolWeight> (1,700)
246.64588

>  <PCAT_CMPD_ID> (1,700)
CL-419631

>  <CNC_ID> (1,700)
359380571

>  <transfer_container_id> (1,700)
PTN000000071

>  <COMPOUND_NUMBER> (1,700)
CL-419631

>  <BAR_CODE_NO> (1,700)
3905345

>  <LOCATION_CODE> (1,700)
PTNCS

>  <AMOUNT_CURRENT> (1,700)
33.4

$$$$
CL-422954
csChFnd80/10111816222D

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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,701)
1701

>  <Formula> (1,701)
C16H19N5

>  <MolWeight> (1,701)
281.35556

>  <PCAT_CMPD_ID> (1,701)
CL-422954

>  <CNC_ID> (1,701)
359380580

>  <transfer_container_id> (1,701)
PTN000000071

>  <COMPOUND_NUMBER> (1,701)
CL-422954

>  <BAR_CODE_NO> (1,701)
3905273

>  <LOCATION_CODE> (1,701)
PTNCS

>  <AMOUNT_CURRENT> (1,701)
33.3

$$$$
CL-423140
csChFnd80/10111816222D

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 22 23  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,702)
1702

>  <Formula> (1,702)
C19H19F3N4OS

>  <MolWeight> (1,702)
408.4405696

>  <PCAT_CMPD_ID> (1,702)
CL-423140

>  <CNC_ID> (1,702)
359380581

>  <transfer_container_id> (1,702)
PTN000000071

>  <COMPOUND_NUMBER> (1,702)
CL-423140

>  <BAR_CODE_NO> (1,702)
3905807

>  <LOCATION_CODE> (1,702)
PTNCS

>  <AMOUNT_CURRENT> (1,702)
33.4

$$$$
CL-424707
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10  9  3  0  0  0  0
 11  5  1  0  0  0  0
 12  8  1  0  0  0  0
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 14 12  1  0  0  0  0
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M  END
>  <Mol_ID> (1,703)
1703

>  <Formula> (1,703)
C17H19N3O2

>  <MolWeight> (1,703)
297.35166

>  <PCAT_CMPD_ID> (1,703)
CL-424707

>  <CNC_ID> (1,703)
359380585

>  <transfer_container_id> (1,703)
PTN000000071

>  <COMPOUND_NUMBER> (1,703)
CL-424707

>  <BAR_CODE_NO> (1,703)
3905958

>  <LOCATION_CODE> (1,703)
PTNCS

>  <AMOUNT_CURRENT> (1,703)
33.3

$$$$
CL-426958
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,704)
1704

>  <Formula> (1,704)
C17H18N4

>  <MolWeight> (1,704)
278.35162

>  <PCAT_CMPD_ID> (1,704)
CL-426958

>  <CNC_ID> (1,704)
359380590

>  <transfer_container_id> (1,704)
PTN000000071

>  <COMPOUND_NUMBER> (1,704)
CL-426958

>  <BAR_CODE_NO> (1,704)
3904694

>  <LOCATION_CODE> (1,704)
PTNCS

>  <AMOUNT_CURRENT> (1,704)
33.4

$$$$
CL-431817
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,705)
1705

>  <Formula> (1,705)
C15H17NO4

>  <MolWeight> (1,705)
275.29978

>  <PCAT_CMPD_ID> (1,705)
CL-431817

>  <CNC_ID> (1,705)
359380595

>  <transfer_container_id> (1,705)
PTN000000071

>  <COMPOUND_NUMBER> (1,705)
CL-431817

>  <BAR_CODE_NO> (1,705)
3904612

>  <LOCATION_CODE> (1,705)
PTNCS

>  <AMOUNT_CURRENT> (1,705)
33.4

$$$$
CL-75900
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,706)
1706

>  <Formula> (1,706)
C13H9N3O

>  <MolWeight> (1,706)
223.23006

>  <PCAT_CMPD_ID> (1,706)
CL-75900

>  <CNC_ID> (1,706)
359380604

>  <transfer_container_id> (1,706)
PTN000000071

>  <COMPOUND_NUMBER> (1,706)
CL-75900

>  <BAR_CODE_NO> (1,706)
3905853

>  <LOCATION_CODE> (1,706)
PTNCS

>  <AMOUNT_CURRENT> (1,706)
33.1

$$$$
CL-84885
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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  9 11  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,707)
1707

>  <Formula> (1,707)
C15H16N2O3S

>  <MolWeight> (1,707)
304.36414

>  <PCAT_CMPD_ID> (1,707)
CL-84885

>  <CNC_ID> (1,707)
359380606

>  <transfer_container_id> (1,707)
PTN000000071

>  <COMPOUND_NUMBER> (1,707)
CL-84885

>  <BAR_CODE_NO> (1,707)
3904244

>  <LOCATION_CODE> (1,707)
PTNCS

>  <AMOUNT_CURRENT> (1,707)
33.5

$$$$
CL-900825
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,708)
1708

>  <Formula> (1,708)
C15H10BrN3OS

>  <MolWeight> (1,708)
360.2284

>  <PCAT_CMPD_ID> (1,708)
CL-900825

>  <CNC_ID> (1,708)
359380608

>  <transfer_container_id> (1,708)
PTN000000071

>  <COMPOUND_NUMBER> (1,708)
CL-900825

>  <BAR_CODE_NO> (1,708)
3904724

>  <LOCATION_CODE> (1,708)
PTNCS

>  <AMOUNT_CURRENT> (1,708)
33.3

$$$$
GI-503998
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,709)
1709

>  <Formula> (1,709)
C13H8O3

>  <MolWeight> (1,709)
212.20082

>  <PCAT_CMPD_ID> (1,709)
GI-503998

>  <CNC_ID> (1,709)
359380610

>  <transfer_container_id> (1,709)
PTN000000071

>  <COMPOUND_NUMBER> (1,709)
GI-503998

>  <BAR_CODE_NO> (1,709)
3905140

>  <LOCATION_CODE> (1,709)
PTNCS

>  <AMOUNT_CURRENT> (1,709)
33.1

$$$$
SD-33401
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,710)
1710

>  <Formula> (1,710)
C17H14N2OS

>  <MolWeight> (1,710)
294.37086

>  <PCAT_CMPD_ID> (1,710)
SD-33401

>  <CNC_ID> (1,710)
359380633

>  <transfer_container_id> (1,710)
PTN000000071

>  <COMPOUND_NUMBER> (1,710)
SD-33401

>  <BAR_CODE_NO> (1,710)
2543116

>  <LOCATION_CODE> (1,710)
PTNCS

>  <AMOUNT_CURRENT> (1,710)
32.4

$$$$
SD-36120
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,711)
1711

>  <Formula> (1,711)
C13H15NO2S2

>  <MolWeight> (1,711)
281.3937

>  <PCAT_CMPD_ID> (1,711)
SD-36120

>  <CNC_ID> (1,711)
359380634

>  <transfer_container_id> (1,711)
PTN000000071

>  <COMPOUND_NUMBER> (1,711)
SD-36120

>  <BAR_CODE_NO> (1,711)
3905971

>  <LOCATION_CODE> (1,711)
PTNCS

>  <AMOUNT_CURRENT> (1,711)
33.3

$$$$
WAY-112563
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    1.5039    0.8072    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5212    0.8072    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  2  7  2  0  0  0  0
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  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  2  0  0  0  0
 10 15  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
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  9 12  1  0  0  0  0
 16 18  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,712)
1712

>  <Formula> (1,712)
C18H17ClN2O4S

>  <MolWeight> (1,712)
392.85658

>  <PCAT_CMPD_ID> (1,712)
WAY-112563

>  <CNC_ID> (1,712)
359380642

>  <transfer_container_id> (1,712)
PTN000000071

>  <COMPOUND_NUMBER> (1,712)
WAY-112563

>  <BAR_CODE_NO> (1,712)
3904235

>  <LOCATION_CODE> (1,712)
PTNCS

>  <AMOUNT_CURRENT> (1,712)
33.2

$$$$
WAY-113583
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    4.2104    4.8689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8000    4.8689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  3  1  0  0  0  0
  8  3  1  0  0  0  0
  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11  2  2  0  0  0  0
 12  4  2  0  0  0  0
 13  6  1  0  0  0  0
 14 23  1  0  0  0  0
 15 10  2  0  0  0  0
 16 10  1  0  0  0  0
 17 18  1  0  0  0  0
 18 16  2  0  0  0  0
 19 15  1  0  0  0  0
 20 17  1  0  0  0  0
 21  7  1  0  0  0  0
 22  7  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
  8 13  2  0  0  0  0
 17 19  2  0  0  0  0
 24 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,713)
1713

>  <Formula> (1,713)
C17H15ClN2O4

>  <MolWeight> (1,713)
346.765

>  <PCAT_CMPD_ID> (1,713)
WAY-113583

>  <CNC_ID> (1,713)
359380646

>  <transfer_container_id> (1,713)
PTN000000071

>  <COMPOUND_NUMBER> (1,713)
WAY-113583

>  <BAR_CODE_NO> (1,713)
3904477

>  <LOCATION_CODE> (1,713)
PTNCS

>  <AMOUNT_CURRENT> (1,713)
33.4

$$$$
WAY-113805
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.8305    2.1464    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0125    2.8618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
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  7  9  1  0  0  0  0
  8  5  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  4  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  2  0  0  0  0
 14 11  2  0  0  0  0
 15 11  1  0  0  0  0
 16 17  1  0  0  0  0
 17 20  1  0  0  0  0
 18  7  1  0  0  0  0
 19 14  1  0  0  0  0
 20 15  2  0  0  0  0
 21  5  2  0  0  0  0
 22 23  2  0  0  0  0
 23 21  1  0  0  0  0
 24 16  1  0  0  0  0
 25 24  1  0  0  0  0
 26 24  1  0  0  0  0
  4  6  1  0  0  0  0
  9 22  1  0  0  0  0
 19 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,714)
1714

>  <Formula> (1,714)
C20H19NO5

>  <MolWeight> (1,714)
353.36856

>  <PCAT_CMPD_ID> (1,714)
WAY-113805

>  <CNC_ID> (1,714)
359380649

>  <transfer_container_id> (1,714)
PTN000000071

>  <COMPOUND_NUMBER> (1,714)
WAY-113805

>  <BAR_CODE_NO> (1,714)
3905785

>  <LOCATION_CODE> (1,714)
PTNCS

>  <AMOUNT_CURRENT> (1,714)
33.3

$$$$
WAY-115046
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.3688   -1.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7446   -0.3859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
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 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
  5  7  2  0  0  0  0
  8 10  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,715)
1715

>  <Formula> (1,715)
C15H11ClN2O2

>  <MolWeight> (1,715)
286.71304

>  <PCAT_CMPD_ID> (1,715)
WAY-115046

>  <CNC_ID> (1,715)
359380658

>  <transfer_container_id> (1,715)
PTN000000071

>  <COMPOUND_NUMBER> (1,715)
WAY-115046

>  <BAR_CODE_NO> (1,715)
3905456

>  <LOCATION_CODE> (1,715)
PTNCS

>  <AMOUNT_CURRENT> (1,715)
33.2

$$$$
WAY-115092
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    2.8228    7.7623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18  8  1  0  0  0  0
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 17 16  2  0  0  0  0
 26 27  1  0  0  0  0
 10  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,716)
1716

>  <Formula> (1,716)
C21H18N2O3S

>  <MolWeight> (1,716)
378.44422

>  <PCAT_CMPD_ID> (1,716)
WAY-115092

>  <CNC_ID> (1,716)
359380659

>  <transfer_container_id> (1,716)
PTN000000071

>  <COMPOUND_NUMBER> (1,716)
WAY-115092

>  <BAR_CODE_NO> (1,716)
3904138

>  <LOCATION_CODE> (1,716)
PTNCS

>  <AMOUNT_CURRENT> (1,716)
33.2

$$$$
WAY-115180
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  1  1  0  0  0  0
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 13  3  1  0  0  0  0
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 15  8  1  0  0  0  0
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 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,717)
1717

>  <Formula> (1,717)
C18H24O2

>  <MolWeight> (1,717)
272.38196

>  <PCAT_CMPD_ID> (1,717)
WAY-115180

>  <CNC_ID> (1,717)
359380660

>  <transfer_container_id> (1,717)
PTN000000071

>  <COMPOUND_NUMBER> (1,717)
WAY-115180

>  <BAR_CODE_NO> (1,717)
3905361

>  <LOCATION_CODE> (1,717)
PTNCS

>  <AMOUNT_CURRENT> (1,717)
33.5

$$$$
WAY-118406
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.5760    0.0241    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 10 13  1  0  0  0  0
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 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
  9 12  1  0  0  0  0
 14 16  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,718)
1718

>  <Formula> (1,718)
C15H15ClN2O4S

>  <MolWeight> (1,718)
354.8086

>  <PCAT_CMPD_ID> (1,718)
WAY-118406

>  <CNC_ID> (1,718)
359380691

>  <transfer_container_id> (1,718)
PTN000000071

>  <COMPOUND_NUMBER> (1,718)
WAY-118406

>  <BAR_CODE_NO> (1,718)
3904171

>  <LOCATION_CODE> (1,718)
PTNCS

>  <AMOUNT_CURRENT> (1,718)
33.4

$$$$
WAY-118985
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -1.1683   -0.4354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,719)
1719

>  <Formula> (1,719)
C13H12N4S2

>  <MolWeight> (1,719)
288.39118

>  <PCAT_CMPD_ID> (1,719)
WAY-118985

>  <CNC_ID> (1,719)
359380706

>  <transfer_container_id> (1,719)
PTN000000071

>  <COMPOUND_NUMBER> (1,719)
WAY-118985

>  <BAR_CODE_NO> (1,719)
3904377

>  <LOCATION_CODE> (1,719)
PTNCS

>  <AMOUNT_CURRENT> (1,719)
33.2

$$$$
WAY-119884
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
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 12  2  1  0  0  0  0
 13 14  1  0  0  0  0
 14  5  2  0  0  0  0
 15 12  1  0  0  0  0
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 17 10  1  0  0  0  0
  8 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,720)
1720

>  <Formula> (1,720)
C14H20N2O2

>  <MolWeight> (1,720)
248.3208

>  <PCAT_CMPD_ID> (1,720)
WAY-119884

>  <CNC_ID> (1,720)
359380716

>  <transfer_container_id> (1,720)
PTN000000071

>  <COMPOUND_NUMBER> (1,720)
WAY-119884

>  <BAR_CODE_NO> (1,720)
3905452

>  <LOCATION_CODE> (1,720)
PTNCS

>  <AMOUNT_CURRENT> (1,720)
33.4

$$$$
WAY-215361
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 25  8  1  0  0  0  0
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 14  9  2  0  0  0  0
 21 22  1  0  0  0  0
 19  8  1  0  0  0  0
M  END
>  <Mol_ID> (1,721)
1721

>  <Formula> (1,721)
C19H20ClN3O3

>  <MolWeight> (1,721)
373.8334

>  <PCAT_CMPD_ID> (1,721)
WAY-215361

>  <CNC_ID> (1,721)
359380723

>  <transfer_container_id> (1,721)
PTN000000071

>  <COMPOUND_NUMBER> (1,721)
WAY-215361

>  <BAR_CODE_NO> (1,721)
3905628

>  <LOCATION_CODE> (1,721)
PTNCS

>  <AMOUNT_CURRENT> (1,721)
33.5

$$$$
WAY-216469
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
   10.7420   -3.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  1  0  0  0  0
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 15  5  2  0  0  0  0
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 24  9  2  0  0  0  0
 22 20  2  0  0  0  0
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M  END
>  <Mol_ID> (1,722)
1722

>  <Formula> (1,722)
C23H21N3O6S

>  <MolWeight> (1,722)
467.49434

>  <PCAT_CMPD_ID> (1,722)
WAY-216469

>  <CNC_ID> (1,722)
359380731

>  <transfer_container_id> (1,722)
PTN000000071

>  <COMPOUND_NUMBER> (1,722)
WAY-216469

>  <BAR_CODE_NO> (1,722)
3905001

>  <LOCATION_CODE> (1,722)
PTNCS

>  <AMOUNT_CURRENT> (1,722)
33.3

$$$$
WAY-217220
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 18 19  1  0  0  0  0
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 10 12  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,723)
1723

>  <Formula> (1,723)
C14H10BrN3S

>  <MolWeight> (1,723)
332.2183

>  <PCAT_CMPD_ID> (1,723)
WAY-217220

>  <CNC_ID> (1,723)
359380735

>  <transfer_container_id> (1,723)
PTN000000071

>  <COMPOUND_NUMBER> (1,723)
WAY-217220

>  <BAR_CODE_NO> (1,723)
3904980

>  <LOCATION_CODE> (1,723)
PTNCS

>  <AMOUNT_CURRENT> (1,723)
33.4

$$$$
WAY-217397
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
    3.6780   -2.4359    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 13  2  1  0  0  0  0
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 10 13  1  0  0  0  0
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 14 15  1  0  0  0  0
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M  END
>  <Mol_ID> (1,724)
1724

>  <Formula> (1,724)
C9H8ClN3OS

>  <MolWeight> (1,724)
241.69732

>  <PCAT_CMPD_ID> (1,724)
WAY-217397

>  <CNC_ID> (1,724)
359380737

>  <transfer_container_id> (1,724)
PTN000000071

>  <COMPOUND_NUMBER> (1,724)
WAY-217397

>  <BAR_CODE_NO> (1,724)
3904610

>  <LOCATION_CODE> (1,724)
PTNCS

>  <AMOUNT_CURRENT> (1,724)
33.1

$$$$
WAY-218040
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  3  2  0  0  0  0
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 13  8  1  0  0  0  0
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  5  4  1  0  0  0  0
 29 28  2  0  0  0  0
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 14 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,725)
1725

>  <Formula> (1,725)
C22H23N3O4

>  <MolWeight> (1,725)
393.43572

>  <PCAT_CMPD_ID> (1,725)
WAY-218040

>  <CNC_ID> (1,725)
359380740

>  <transfer_container_id> (1,725)
PTN000000071

>  <COMPOUND_NUMBER> (1,725)
WAY-218040

>  <BAR_CODE_NO> (1,725)
3905925

>  <LOCATION_CODE> (1,725)
PTNCS

>  <AMOUNT_CURRENT> (1,725)
33.4

$$$$
WAY-218546
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
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 13  4  1  0  0  0  0
 14  6  1  0  0  0  0
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 16  7  2  0  0  0  0
 17  3  2  0  0  0  0
 18 20  1  0  0  0  0
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 25 21  1  0  0  0  0
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 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,726)
1726

>  <Formula> (1,726)
C17H17NO6S

>  <MolWeight> (1,726)
363.38498

>  <PCAT_CMPD_ID> (1,726)
WAY-218546

>  <CNC_ID> (1,726)
359380745

>  <transfer_container_id> (1,726)
PTN000000071

>  <COMPOUND_NUMBER> (1,726)
WAY-218546

>  <BAR_CODE_NO> (1,726)
3905391

>  <LOCATION_CODE> (1,726)
PTNCS

>  <AMOUNT_CURRENT> (1,726)
33.3

$$$$
WAY-222900
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    4.7306    8.4705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9443    9.2134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4459    2.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2012    4.2476    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3562    0.6252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.3591    9.2443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  1  2  0  0  0  0
  5  8  1  0  0  0  0
  6  4  1  0  0  0  0
  7  6  1  0  0  0  0
  8 16  1  0  0  0  0
  9  1  1  0  0  0  0
 10  3  2  0  0  0  0
 11  2  2  0  0  0  0
 12  2  1  0  0  0  0
 13  5  2  0  0  0  0
 14  4  1  0  0  0  0
 15  7  2  0  0  0  0
 16  7  1  0  0  0  0
 17  9  2  0  0  0  0
 18 10  1  0  0  0  0
 19 17  1  0  0  0  0
 20 17  1  0  0  0  0
 21  3  1  0  0  0  0
 22 10  1  0  0  0  0
 23 12  2  0  0  0  0
 24 12  1  0  0  0  0
 25 21  2  0  0  0  0
 26 24  2  0  0  0  0
 27 23  1  0  0  0  0
 28 25  1  0  0  0  0
 29 26  1  0  0  0  0
 14 19  2  0  0  0  0
 29 27  2  0  0  0  0
 22 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,727)
1727

>  <Formula> (1,727)
C22H16BrClN2O3

>  <MolWeight> (1,727)
471.73104

>  <PCAT_CMPD_ID> (1,727)
WAY-222900

>  <CNC_ID> (1,727)
359380762

>  <transfer_container_id> (1,727)
PTN000000071

>  <COMPOUND_NUMBER> (1,727)
WAY-222900

>  <BAR_CODE_NO> (1,727)
3905214

>  <LOCATION_CODE> (1,727)
PTNCS

>  <AMOUNT_CURRENT> (1,727)
33.2

$$$$
WAY-223814
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
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  4 10  2  0  0  0  0
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  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  2  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
  7  9  2  0  0  0  0
 11 12  2  0  0  0  0
 16 17  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,728)
1728

>  <Formula> (1,728)
C18H11ClN2O2S

>  <MolWeight> (1,728)
354.81014

>  <PCAT_CMPD_ID> (1,728)
WAY-223814

>  <CNC_ID> (1,728)
359380767

>  <transfer_container_id> (1,728)
PTN000000071

>  <COMPOUND_NUMBER> (1,728)
WAY-223814

>  <BAR_CODE_NO> (1,728)
3904417

>  <LOCATION_CODE> (1,728)
PTNCS

>  <AMOUNT_CURRENT> (1,728)
33.4

$$$$
WAY-223915
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  2  0  0  0  0
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 10  6  1  0  0  0  0
 11  7  2  0  0  0  0
 12  7  1  0  0  0  0
 13 15  1  0  0  0  0
 14 10  1  0  0  0  0
 15 12  2  0  0  0  0
 16 11  1  0  0  0  0
 17  6  1  0  0  0  0
 18 13  1  0  0  0  0
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 20 14  2  0  0  0  0
 21 14  1  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  2  0  0  0  0
 25 24  1  0  0  0  0
  5  4  1  0  0  0  0
 16 13  2  0  0  0  0
 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,729)
1729

>  <Formula> (1,729)
C20H22N2O3

>  <MolWeight> (1,729)
338.40028

>  <PCAT_CMPD_ID> (1,729)
WAY-223915

>  <CNC_ID> (1,729)
359380769

>  <transfer_container_id> (1,729)
PTN000000071

>  <COMPOUND_NUMBER> (1,729)
WAY-223915

>  <BAR_CODE_NO> (1,729)
3904293

>  <LOCATION_CODE> (1,729)
PTNCS

>  <AMOUNT_CURRENT> (1,729)
33.3

$$$$
WAY-224056-A
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  2  0  0  0  0
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  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
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 10 17  2  0  0  0  0
 11  3  2  0  0  0  0
 12  6  1  0  0  0  0
 13  6  2  0  0  0  0
 14  9  1  0  0  0  0
 15  9  2  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 14  1  0  0  0  0
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 20  4  1  0  0  0  0
 21  5  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
  4  7  2  0  0  0  0
 10 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,730)
1730

>  <Formula> (1,730)
C16H18N4O4

>  <MolWeight> (1,730)
330.33852

>  <PCAT_CMPD_ID> (1,730)
WAY-224056-A

>  <CNC_ID> (1,730)
359380770

>  <transfer_container_id> (1,730)
PTN000000071

>  <COMPOUND_NUMBER> (1,730)
WAY-224056-A

>  <BAR_CODE_NO> (1,730)
3904419

>  <LOCATION_CODE> (1,730)
PTNCS

>  <AMOUNT_CURRENT> (1,730)
33

$$$$
WAY-224672
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  2  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 17 19  1  0  0  0  0
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 23 26  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,731)
1731

>  <Formula> (1,731)
C18H20N2O5S

>  <MolWeight> (1,731)
376.4268

>  <PCAT_CMPD_ID> (1,731)
WAY-224672

>  <CNC_ID> (1,731)
359380773

>  <transfer_container_id> (1,731)
PTN000000071

>  <COMPOUND_NUMBER> (1,731)
WAY-224672

>  <BAR_CODE_NO> (1,731)
3904559

>  <LOCATION_CODE> (1,731)
PTNCS

>  <AMOUNT_CURRENT> (1,731)
33

$$$$
WAY-225220
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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   14.2023    0.8070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 11  1  0  0  0  0
  4  1  1  0  0  0  0
  5 14  1  0  0  0  0
  6  3  1  0  0  0  0
  7  4  2  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  2  1  0  0  0  0
 11 13  2  0  0  0  0
 12  1  2  0  0  0  0
 13  7  1  0  0  0  0
 14 16  2  0  0  0  0
 15 10  1  0  0  0  0
 16 13  1  0  0  0  0
 17 10  1  0  0  0  0
 18 15  1  0  0  0  0
 19 15  2  0  0  0  0
 20 19  1  0  0  0  0
 21 18  2  0  0  0  0
 22 20  2  0  0  0  0
  3  5  2  0  0  0  0
 21 22  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
>  <Mol_ID> (1,732)
1732

>  <Formula> (1,732)
C18H17NO3

>  <MolWeight> (1,732)
295.33248

>  <PCAT_CMPD_ID> (1,732)
WAY-225220

>  <CNC_ID> (1,732)
359380777

>  <transfer_container_id> (1,732)
PTN000000071

>  <COMPOUND_NUMBER> (1,732)
WAY-225220

>  <BAR_CODE_NO> (1,732)
3904456

>  <LOCATION_CODE> (1,732)
PTNCS

>  <AMOUNT_CURRENT> (1,732)
33.5

$$$$
WAY-225391
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  2  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  4  1  0  0  0  0
 11  3  1  0  0  0  0
 12 15  2  0  0  0  0
 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
 15 14  1  0  0  0  0
 16 13  2  0  0  0  0
 17 10  1  0  0  0  0
 18  8  2  0  0  0  0
 19  8  1  0  0  0  0
 20 12  1  0  0  0  0
 21 19  2  0  0  0  0
 22 18  1  0  0  0  0
 23 21  1  0  0  0  0
  5  3  1  0  0  0  0
 12 16  1  0  0  0  0
 17 11  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,733)
1733

>  <Formula> (1,733)
C21H23NO

>  <MolWeight> (1,733)
305.41342

>  <PCAT_CMPD_ID> (1,733)
WAY-225391

>  <CNC_ID> (1,733)
359380779

>  <transfer_container_id> (1,733)
PTN000000071

>  <COMPOUND_NUMBER> (1,733)
WAY-225391

>  <BAR_CODE_NO> (1,733)
3905164

>  <LOCATION_CODE> (1,733)
PTNCS

>  <AMOUNT_CURRENT> (1,733)
33.5

$$$$
WAY-225408
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12 13  1  0  0  0  0
  2 13  2  0  0  0  0
 14  3  1  0  0  0  0
 15 14  3  0  0  0  0
 16  5  2  0  0  0  0
 11 17  2  0  0  0  0
 18  9  1  0  0  0  0
 19 17  1  0  0  0  0
 20 10  1  0  0  0  0
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  9 10  2  0  0  0  0
 18 23  1  0  0  0  0
  6 12  1  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (1,734)
1734

>  <Formula> (1,734)
C19H14ClN3O2S

>  <MolWeight> (1,734)
383.85136

>  <PCAT_CMPD_ID> (1,734)
WAY-225408

>  <CNC_ID> (1,734)
359380782

>  <transfer_container_id> (1,734)
PTN000000071

>  <COMPOUND_NUMBER> (1,734)
WAY-225408

>  <BAR_CODE_NO> (1,734)
3905296

>  <LOCATION_CODE> (1,734)
PTNCS

>  <AMOUNT_CURRENT> (1,734)
33.1

$$$$
WAY-231059
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10 13  2  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
  5  8  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,735)
1735

>  <Formula> (1,735)
C10H7N3O4

>  <MolWeight> (1,735)
233.18028

>  <PCAT_CMPD_ID> (1,735)
WAY-231059

>  <CNC_ID> (1,735)
359380804

>  <transfer_container_id> (1,735)
PTN000000071

>  <COMPOUND_NUMBER> (1,735)
WAY-231059

>  <BAR_CODE_NO> (1,735)
3906124

>  <LOCATION_CODE> (1,735)
PTNCS

>  <AMOUNT_CURRENT> (1,735)
33.3

$$$$
WAY-232956
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  5  7  1  0  0  0  0
 12 14  1  0  0  0  0
 23 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,736)
1736

>  <Formula> (1,736)
C19H22N2O3S

>  <MolWeight> (1,736)
358.45458

>  <PCAT_CMPD_ID> (1,736)
WAY-232956

>  <CNC_ID> (1,736)
359380831

>  <transfer_container_id> (1,736)
PTN000000071

>  <COMPOUND_NUMBER> (1,736)
WAY-232956

>  <BAR_CODE_NO> (1,736)
3904777

>  <LOCATION_CODE> (1,736)
PTNCS

>  <AMOUNT_CURRENT> (1,736)
33.5

$$$$
WAY-233127
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 12 15  1  0  0  0  0
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M  END
>  <Mol_ID> (1,737)
1737

>  <Formula> (1,737)
C18H16FN3O2

>  <MolWeight> (1,737)
325.3369432

>  <PCAT_CMPD_ID> (1,737)
WAY-233127

>  <CNC_ID> (1,737)
359380832

>  <transfer_container_id> (1,737)
PTN000000071

>  <COMPOUND_NUMBER> (1,737)
WAY-233127

>  <BAR_CODE_NO> (1,737)
3904989

>  <LOCATION_CODE> (1,737)
PTNCS

>  <AMOUNT_CURRENT> (1,737)
33.2

$$$$
WAY-233273
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  9  2  0  0  0  0
 12 11  1  0  0  0  0
 13  4  1  0  0  0  0
 14  5  1  0  0  0  0
 15 12  1  0  0  0  0
 13 14  1  0  0  0  0
 10 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,738)
1738

>  <Formula> (1,738)
C11H12N2OS

>  <MolWeight> (1,738)
220.29078

>  <PCAT_CMPD_ID> (1,738)
WAY-233273

>  <CNC_ID> (1,738)
359380838

>  <transfer_container_id> (1,738)
PTN000000071

>  <COMPOUND_NUMBER> (1,738)
WAY-233273

>  <BAR_CODE_NO> (1,738)
3904862

>  <LOCATION_CODE> (1,738)
PTNCS

>  <AMOUNT_CURRENT> (1,738)
33.1

$$$$
WAY-234945
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 18 20  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,739)
1739

>  <Formula> (1,739)
C22H28N2O3S

>  <MolWeight> (1,739)
400.53432

>  <PCAT_CMPD_ID> (1,739)
WAY-234945

>  <CNC_ID> (1,739)
359380857

>  <transfer_container_id> (1,739)
PTN000000071

>  <COMPOUND_NUMBER> (1,739)
WAY-234945

>  <BAR_CODE_NO> (1,739)
3905868

>  <LOCATION_CODE> (1,739)
PTNCS

>  <AMOUNT_CURRENT> (1,739)
33

$$$$
WAY-237387
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  6  2  0  0  0  0
 12  9  1  0  0  0  0
 13  6  1  0  0  0  0
 14  1  1  0  0  0  0
 15  1  1  0  0  0  0
 16  2  1  0  0  0  0
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 18  9  2  0  0  0  0
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  8  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,740)
1740

>  <Formula> (1,740)
C16H21NO4

>  <MolWeight> (1,740)
291.34224

>  <PCAT_CMPD_ID> (1,740)
WAY-237387

>  <CNC_ID> (1,740)
359380880

>  <transfer_container_id> (1,740)
PTN000000071

>  <COMPOUND_NUMBER> (1,740)
WAY-237387

>  <BAR_CODE_NO> (1,740)
3905514

>  <LOCATION_CODE> (1,740)
PTNCS

>  <AMOUNT_CURRENT> (1,740)
33.1

$$$$
WAY-237680-B
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,741)
1741

>  <Formula> (1,741)
C16H22N4

>  <MolWeight> (1,741)
270.37268

>  <PCAT_CMPD_ID> (1,741)
WAY-237680-B

>  <CNC_ID> (1,741)
359380883

>  <transfer_container_id> (1,741)
PTN000000071

>  <COMPOUND_NUMBER> (1,741)
WAY-237680-B

>  <BAR_CODE_NO> (1,741)
3905250

>  <LOCATION_CODE> (1,741)
PTNCS

>  <AMOUNT_CURRENT> (1,741)
33.5

$$$$
WAY-240246
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  4  1  0  0  0  0
 11  8  1  0  0  0  0
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M  END
>  <Mol_ID> (1,742)
1742

>  <Formula> (1,742)
C18H19NO

>  <MolWeight> (1,742)
265.34956

>  <PCAT_CMPD_ID> (1,742)
WAY-240246

>  <CNC_ID> (1,742)
359380897

>  <transfer_container_id> (1,742)
PTN000000071

>  <COMPOUND_NUMBER> (1,742)
WAY-240246

>  <BAR_CODE_NO> (1,742)
3904525

>  <LOCATION_CODE> (1,742)
PTNCS

>  <AMOUNT_CURRENT> (1,742)
33.2

$$$$
WAY-243225-A
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 14  3  1  0  0  0  0
 15  6  1  0  0  0  0
 16  8  1  0  0  0  0
 17  7  1  0  0  0  0
 18  1  1  0  0  0  0
 19 18  1  0  0  0  0
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  4 17  1  0  0  0  0
 13 15  1  0  0  0  0
  5 11  2  0  0  0  0
M  END
>  <Mol_ID> (1,743)
1743

>  <Formula> (1,743)
C15H26N2O2S

>  <MolWeight> (1,743)
298.44414

>  <PCAT_CMPD_ID> (1,743)
WAY-243225-A

>  <CNC_ID> (1,743)
359380913

>  <transfer_container_id> (1,743)
PTN000000071

>  <COMPOUND_NUMBER> (1,743)
WAY-243225-A

>  <BAR_CODE_NO> (1,743)
3905093

>  <LOCATION_CODE> (1,743)
PTNCS

>  <AMOUNT_CURRENT> (1,743)
33.2

$$$$
WAY-246859
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 26 29  1  0  0  0  0
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 16 20  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,744)
1744

>  <Formula> (1,744)
C19H20N4O4S2

>  <MolWeight> (1,744)
432.5165

>  <PCAT_CMPD_ID> (1,744)
WAY-246859

>  <CNC_ID> (1,744)
359380918

>  <transfer_container_id> (1,744)
PTN000000071

>  <COMPOUND_NUMBER> (1,744)
WAY-246859

>  <BAR_CODE_NO> (1,744)
3905285

>  <LOCATION_CODE> (1,744)
PTNCS

>  <AMOUNT_CURRENT> (1,744)
33.2

$$$$
WAY-301647
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 18 23  2  0  0  0  0
 22 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,745)
1745

>  <Formula> (1,745)
C21H18N4O3

>  <MolWeight> (1,745)
374.39262

>  <PCAT_CMPD_ID> (1,745)
WAY-301647

>  <CNC_ID> (1,745)
359382633

>  <transfer_container_id> (1,745)
PTN000000071

>  <COMPOUND_NUMBER> (1,745)
WAY-301647

>  <BAR_CODE_NO> (1,745)
3904133

>  <LOCATION_CODE> (1,745)
PTNCS

>  <AMOUNT_CURRENT> (1,745)
33

$$$$
WAY-301657
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  7  8  1  0  0  0  0
 10 12  1  0  0  0  0
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M  END
>  <Mol_ID> (1,746)
1746

>  <Formula> (1,746)
C16H11ClN2OS

>  <MolWeight> (1,746)
314.78934

>  <PCAT_CMPD_ID> (1,746)
WAY-301657

>  <CNC_ID> (1,746)
359382643

>  <transfer_container_id> (1,746)
PTN000000071

>  <COMPOUND_NUMBER> (1,746)
WAY-301657

>  <BAR_CODE_NO> (1,746)
3904145

>  <LOCATION_CODE> (1,746)
PTNCS

>  <AMOUNT_CURRENT> (1,746)
33.1

$$$$
WAY-301678
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  5 10  1  0  0  0  0
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 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 22 23  1  0  0  0  0
  5  7  1  0  0  0  0
  8 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,747)
1747

>  <Formula> (1,747)
C15H15FN4O2S

>  <MolWeight> (1,747)
334.3686032

>  <PCAT_CMPD_ID> (1,747)
WAY-301678

>  <CNC_ID> (1,747)
359382664

>  <transfer_container_id> (1,747)
PTN000000071

>  <COMPOUND_NUMBER> (1,747)
WAY-301678

>  <BAR_CODE_NO> (1,747)
3904168

>  <LOCATION_CODE> (1,747)
PTNCS

>  <AMOUNT_CURRENT> (1,747)
33.4

$$$$
WAY-301686
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  2  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
  7  8  1  0  0  0  0
  8 12  1  0  0  0  0
  9  7  2  0  0  0  0
 10  7  1  0  0  0  0
 11 15  2  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 10  2  0  0  0  0
 15  6  1  0  0  0  0
 16 14  1  0  0  0  0
 17  6  2  0  0  0  0
 18 21  2  0  0  0  0
 19  9  1  0  0  0  0
 20 14  1  0  0  0  0
 21 17  1  0  0  0  0
  5  3  1  0  0  0  0
 18 11  1  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (1,748)
1748

>  <Formula> (1,748)
C16H15N3O2

>  <MolWeight> (1,748)
281.3092

>  <PCAT_CMPD_ID> (1,748)
WAY-301686

>  <CNC_ID> (1,748)
359382672

>  <transfer_container_id> (1,748)
PTN000000071

>  <COMPOUND_NUMBER> (1,748)
WAY-301686

>  <BAR_CODE_NO> (1,748)
3904180

>  <LOCATION_CODE> (1,748)
PTNCS

>  <AMOUNT_CURRENT> (1,748)
33.3

$$$$
WAY-301687
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 11 16  2  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  2  0  0  0  0
 25 27  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,749)
1749

>  <Formula> (1,749)
C23H25N3O

>  <MolWeight> (1,749)
359.4641

>  <PCAT_CMPD_ID> (1,749)
WAY-301687

>  <CNC_ID> (1,749)
359382673

>  <transfer_container_id> (1,749)
PTN000000071

>  <COMPOUND_NUMBER> (1,749)
WAY-301687

>  <BAR_CODE_NO> (1,749)
3904181

>  <LOCATION_CODE> (1,749)
PTNCS

>  <AMOUNT_CURRENT> (1,749)
33.3

$$$$
WAY-301697
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
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  6 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5  7  2  0  0  0  0
 13 15  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,750)
1750

>  <Formula> (1,750)
C18H16N2O3S

>  <MolWeight> (1,750)
340.39624

>  <PCAT_CMPD_ID> (1,750)
WAY-301697

>  <CNC_ID> (1,750)
359382683

>  <transfer_container_id> (1,750)
PTN000000071

>  <COMPOUND_NUMBER> (1,750)
WAY-301697

>  <BAR_CODE_NO> (1,750)
3904193

>  <LOCATION_CODE> (1,750)
PTNCS

>  <AMOUNT_CURRENT> (1,750)
33.4

$$$$
WAY-301700
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  6 10  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
  7  8  2  0  0  0  0
  9 10  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,751)
1751

>  <Formula> (1,751)
C15H13N3O4S

>  <MolWeight> (1,751)
331.34642

>  <PCAT_CMPD_ID> (1,751)
WAY-301700

>  <CNC_ID> (1,751)
359382686

>  <transfer_container_id> (1,751)
PTN000000071

>  <COMPOUND_NUMBER> (1,751)
WAY-301700

>  <BAR_CODE_NO> (1,751)
3904196

>  <LOCATION_CODE> (1,751)
PTNCS

>  <AMOUNT_CURRENT> (1,751)
33.1

$$$$
WAY-301718
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  7 10  1  0  0  0  0
 15 18  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,752)
1752

>  <Formula> (1,752)
C17H14N2O4

>  <MolWeight> (1,752)
310.30406

>  <PCAT_CMPD_ID> (1,752)
WAY-301718

>  <CNC_ID> (1,752)
359382704

>  <transfer_container_id> (1,752)
PTN000000071

>  <COMPOUND_NUMBER> (1,752)
WAY-301718

>  <BAR_CODE_NO> (1,752)
3904217

>  <LOCATION_CODE> (1,752)
PTNCS

>  <AMOUNT_CURRENT> (1,752)
33.1

$$$$
WAY-301719
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,753)
1753

>  <Formula> (1,753)
C18H16N2O5

>  <MolWeight> (1,753)
340.33004

>  <PCAT_CMPD_ID> (1,753)
WAY-301719

>  <CNC_ID> (1,753)
359382705

>  <transfer_container_id> (1,753)
PTN000000071

>  <COMPOUND_NUMBER> (1,753)
WAY-301719

>  <BAR_CODE_NO> (1,753)
3904218

>  <LOCATION_CODE> (1,753)
PTNCS

>  <AMOUNT_CURRENT> (1,753)
33.5

$$$$
WAY-301720
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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 14 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,754)
1754

>  <Formula> (1,754)
C11H8ClN3O

>  <MolWeight> (1,754)
233.65372

>  <PCAT_CMPD_ID> (1,754)
WAY-301720

>  <CNC_ID> (1,754)
359382706

>  <transfer_container_id> (1,754)
PTN000000071

>  <COMPOUND_NUMBER> (1,754)
WAY-301720

>  <BAR_CODE_NO> (1,754)
3904219

>  <LOCATION_CODE> (1,754)
PTNCS

>  <AMOUNT_CURRENT> (1,754)
33.5

$$$$
WAY-301735
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
 12 17  2  0  0  0  0
 13 15  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,755)
1755

>  <Formula> (1,755)
C21H16N2O4S2

>  <MolWeight> (1,755)
424.49274

>  <PCAT_CMPD_ID> (1,755)
WAY-301735

>  <CNC_ID> (1,755)
359382721

>  <transfer_container_id> (1,755)
PTN000000071

>  <COMPOUND_NUMBER> (1,755)
WAY-301735

>  <BAR_CODE_NO> (1,755)
3904238

>  <LOCATION_CODE> (1,755)
PTNCS

>  <AMOUNT_CURRENT> (1,755)
33.3

$$$$
WAY-301785
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 16 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,756)
1756

>  <Formula> (1,756)
C18H13N3O2S

>  <MolWeight> (1,756)
335.37972

>  <PCAT_CMPD_ID> (1,756)
WAY-301785

>  <CNC_ID> (1,756)
359382771

>  <transfer_container_id> (1,756)
PTN000000071

>  <COMPOUND_NUMBER> (1,756)
WAY-301785

>  <BAR_CODE_NO> (1,756)
3904299

>  <LOCATION_CODE> (1,756)
PTNCS

>  <AMOUNT_CURRENT> (1,756)
33

$$$$
WAY-301797
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,757)
1757

>  <Formula> (1,757)
C19H20N4OS

>  <MolWeight> (1,757)
352.4533

>  <PCAT_CMPD_ID> (1,757)
WAY-301797

>  <CNC_ID> (1,757)
359382783

>  <transfer_container_id> (1,757)
PTN000000071

>  <COMPOUND_NUMBER> (1,757)
WAY-301797

>  <BAR_CODE_NO> (1,757)
3904313

>  <LOCATION_CODE> (1,757)
PTNCS

>  <AMOUNT_CURRENT> (1,757)
33.4

$$$$
WAY-301809
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,758)
1758

>  <Formula> (1,758)
C17H14N2O3

>  <MolWeight> (1,758)
294.30466

>  <PCAT_CMPD_ID> (1,758)
WAY-301809

>  <CNC_ID> (1,758)
359382795

>  <transfer_container_id> (1,758)
PTN000000071

>  <COMPOUND_NUMBER> (1,758)
WAY-301809

>  <BAR_CODE_NO> (1,758)
3904325

>  <LOCATION_CODE> (1,758)
PTNCS

>  <AMOUNT_CURRENT> (1,758)
33

$$$$
WAY-301831
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,759)
1759

>  <Formula> (1,759)
C21H25F3N4O5

>  <MolWeight> (1,759)
470.4422096

>  <PCAT_CMPD_ID> (1,759)
WAY-301831

>  <CNC_ID> (1,759)
359382817

>  <transfer_container_id> (1,759)
PTN000000071

>  <COMPOUND_NUMBER> (1,759)
WAY-301831

>  <BAR_CODE_NO> (1,759)
3904348

>  <LOCATION_CODE> (1,759)
PTNCS

>  <AMOUNT_CURRENT> (1,759)
33.3

$$$$
WAY-301834
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,760)
1760

>  <Formula> (1,760)
C15H15FN2O2

>  <MolWeight> (1,760)
274.2902032

>  <PCAT_CMPD_ID> (1,760)
WAY-301834

>  <CNC_ID> (1,760)
359382820

>  <transfer_container_id> (1,760)
PTN000000071

>  <COMPOUND_NUMBER> (1,760)
WAY-301834

>  <BAR_CODE_NO> (1,760)
3904351

>  <LOCATION_CODE> (1,760)
PTNCS

>  <AMOUNT_CURRENT> (1,760)
33.4

$$$$
WAY-301837
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,761)
1761

>  <Formula> (1,761)
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>  <MolWeight> (1,761)
402.8547

>  <PCAT_CMPD_ID> (1,761)
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>  <CNC_ID> (1,761)
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>  <transfer_container_id> (1,761)
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>  <COMPOUND_NUMBER> (1,761)
WAY-301837

>  <BAR_CODE_NO> (1,761)
3904354

>  <LOCATION_CODE> (1,761)
PTNCS

>  <AMOUNT_CURRENT> (1,761)
33.1

$$$$
WAY-301848
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,762)
1762

>  <Formula> (1,762)
C14H15ClN2O3

>  <MolWeight> (1,762)
294.7335

>  <PCAT_CMPD_ID> (1,762)
WAY-301848

>  <CNC_ID> (1,762)
359382834

>  <transfer_container_id> (1,762)
PTN000000071

>  <COMPOUND_NUMBER> (1,762)
WAY-301848

>  <BAR_CODE_NO> (1,762)
3904366

>  <LOCATION_CODE> (1,762)
PTNCS

>  <AMOUNT_CURRENT> (1,762)
33.3

$$$$
WAY-301853
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 21 22  1  0  0  0  0
  9 10  1  0  0  0  0
 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (1,763)
1763

>  <Formula> (1,763)
C17H22N2O2S

>  <MolWeight> (1,763)
318.43378

>  <PCAT_CMPD_ID> (1,763)
WAY-301853

>  <CNC_ID> (1,763)
359382839

>  <transfer_container_id> (1,763)
PTN000000071

>  <COMPOUND_NUMBER> (1,763)
WAY-301853

>  <BAR_CODE_NO> (1,763)
3904374

>  <LOCATION_CODE> (1,763)
PTNCS

>  <AMOUNT_CURRENT> (1,763)
33.1

$$$$
WAY-301861
csChFnd80/10111816222D

 27 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,764)
1764

>  <Formula> (1,764)
C20H23N3O3S

>  <MolWeight> (1,764)
385.47992

>  <PCAT_CMPD_ID> (1,764)
WAY-301861

>  <CNC_ID> (1,764)
359382847

>  <transfer_container_id> (1,764)
PTN000000071

>  <COMPOUND_NUMBER> (1,764)
WAY-301861

>  <BAR_CODE_NO> (1,764)
3904384

>  <LOCATION_CODE> (1,764)
PTNCS

>  <AMOUNT_CURRENT> (1,764)
33.3

$$$$
WAY-301863
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,765)
1765

>  <Formula> (1,765)
C21H21ClN6OS

>  <MolWeight> (1,765)
440.94904

>  <PCAT_CMPD_ID> (1,765)
WAY-301863

>  <CNC_ID> (1,765)
359382849

>  <transfer_container_id> (1,765)
PTN000000071

>  <COMPOUND_NUMBER> (1,765)
WAY-301863

>  <BAR_CODE_NO> (1,765)
3904386

>  <LOCATION_CODE> (1,765)
PTNCS

>  <AMOUNT_CURRENT> (1,765)
33.4

$$$$
WAY-301892
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 29 32  1  0  0  0  0
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 25 28  2  0  0  0  0
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M  END
>  <Mol_ID> (1,766)
1766

>  <Formula> (1,766)
C23H25F3N4O4

>  <MolWeight> (1,766)
478.4642096

>  <PCAT_CMPD_ID> (1,766)
WAY-301892

>  <CNC_ID> (1,766)
359382878

>  <transfer_container_id> (1,766)
PTN000000071

>  <COMPOUND_NUMBER> (1,766)
WAY-301892

>  <BAR_CODE_NO> (1,766)
3904420

>  <LOCATION_CODE> (1,766)
PTNCS

>  <AMOUNT_CURRENT> (1,766)
33.2

$$$$
WAY-301893
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,767)
1767

>  <Formula> (1,767)
C17H10BrF3N4O2S

>  <MolWeight> (1,767)
471.2511096

>  <PCAT_CMPD_ID> (1,767)
WAY-301893

>  <CNC_ID> (1,767)
359382879

>  <transfer_container_id> (1,767)
PTN000000071

>  <COMPOUND_NUMBER> (1,767)
WAY-301893

>  <BAR_CODE_NO> (1,767)
3904422

>  <LOCATION_CODE> (1,767)
PTNCS

>  <AMOUNT_CURRENT> (1,767)
33.4

$$$$
WAY-301899
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11  3  1  0  0  0  0
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 14  7  1  0  0  0  0
 15 10  2  0  0  0  0
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 17  2  1  0  0  0  0
 18  9  1  0  0  0  0
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 20  5  1  0  0  0  0
 21  6  1  0  0  0  0
 22 20  2  0  0  0  0
 23 21  2  0  0  0  0
  5  6  2  0  0  0  0
 22 23  1  0  0  0  0
  9 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,768)
1768

>  <Formula> (1,768)
C16H12N2O4S

>  <MolWeight> (1,768)
328.34248

>  <PCAT_CMPD_ID> (1,768)
WAY-301899

>  <CNC_ID> (1,768)
359382885

>  <transfer_container_id> (1,768)
PTN000000071

>  <COMPOUND_NUMBER> (1,768)
WAY-301899

>  <BAR_CODE_NO> (1,768)
3904428

>  <LOCATION_CODE> (1,768)
PTNCS

>  <AMOUNT_CURRENT> (1,768)
33.1

$$$$
WAY-301901
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
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 17 20  2  0  0  0  0
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M  END
>  <Mol_ID> (1,769)
1769

>  <Formula> (1,769)
C17H15BrN4O3S

>  <MolWeight> (1,769)
435.295

>  <PCAT_CMPD_ID> (1,769)
WAY-301901

>  <CNC_ID> (1,769)
359382887

>  <transfer_container_id> (1,769)
PTN000000071

>  <COMPOUND_NUMBER> (1,769)
WAY-301901

>  <BAR_CODE_NO> (1,769)
3904432

>  <LOCATION_CODE> (1,769)
PTNCS

>  <AMOUNT_CURRENT> (1,769)
33.4

$$$$
WAY-301905
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,770)
1770

>  <Formula> (1,770)
C17H21ClN2O4S

>  <MolWeight> (1,770)
384.87764

>  <PCAT_CMPD_ID> (1,770)
WAY-301905

>  <CNC_ID> (1,770)
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>  <transfer_container_id> (1,770)
PTN000000071

>  <COMPOUND_NUMBER> (1,770)
WAY-301905

>  <BAR_CODE_NO> (1,770)
3904436

>  <LOCATION_CODE> (1,770)
PTNCS

>  <AMOUNT_CURRENT> (1,770)
33.1

$$$$
WAY-301930
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,771)
1771

>  <Formula> (1,771)
C20H18ClF3N4O3S

>  <MolWeight> (1,771)
486.8951296

>  <PCAT_CMPD_ID> (1,771)
WAY-301930

>  <CNC_ID> (1,771)
359382916

>  <transfer_container_id> (1,771)
PTN000000071

>  <COMPOUND_NUMBER> (1,771)
WAY-301930

>  <BAR_CODE_NO> (1,771)
3904471

>  <LOCATION_CODE> (1,771)
PTNCS

>  <AMOUNT_CURRENT> (1,771)
33.4

$$$$
WAY-301954
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,772)
1772

>  <Formula> (1,772)
C23H19N5O2

>  <MolWeight> (1,772)
397.42926

>  <PCAT_CMPD_ID> (1,772)
WAY-301954

>  <CNC_ID> (1,772)
359382940

>  <transfer_container_id> (1,772)
PTN000000071

>  <COMPOUND_NUMBER> (1,772)
WAY-301954

>  <BAR_CODE_NO> (1,772)
3904500

>  <LOCATION_CODE> (1,772)
PTNCS

>  <AMOUNT_CURRENT> (1,772)
33.4

$$$$
WAY-301963
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,773)
1773

>  <Formula> (1,773)
C20H18N2O4S2

>  <MolWeight> (1,773)
414.49792

>  <PCAT_CMPD_ID> (1,773)
WAY-301963

>  <CNC_ID> (1,773)
359382949

>  <transfer_container_id> (1,773)
PTN000000071

>  <COMPOUND_NUMBER> (1,773)
WAY-301963

>  <BAR_CODE_NO> (1,773)
3904511

>  <LOCATION_CODE> (1,773)
PTNCS

>  <AMOUNT_CURRENT> (1,773)
33.1

$$$$
WAY-301981
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,774)
1774

>  <Formula> (1,774)
C12H13NO3S2

>  <MolWeight> (1,774)
283.36652

>  <PCAT_CMPD_ID> (1,774)
WAY-301981

>  <CNC_ID> (1,774)
359382967

>  <transfer_container_id> (1,774)
PTN000000071

>  <COMPOUND_NUMBER> (1,774)
WAY-301981

>  <BAR_CODE_NO> (1,774)
3904532

>  <LOCATION_CODE> (1,774)
PTNCS

>  <AMOUNT_CURRENT> (1,774)
33.2

$$$$
WAY-301992
csChFnd80/10111816222D

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  4  5  2  0  0  0  0
 23 24  1  0  0  0  0
 10 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,775)
1775

>  <Formula> (1,775)
C17H15ClN2O3S

>  <MolWeight> (1,775)
362.8306

>  <PCAT_CMPD_ID> (1,775)
WAY-301992

>  <CNC_ID> (1,775)
359382978

>  <transfer_container_id> (1,775)
PTN000000071

>  <COMPOUND_NUMBER> (1,775)
WAY-301992

>  <BAR_CODE_NO> (1,775)
3904547

>  <LOCATION_CODE> (1,775)
PTNCS

>  <AMOUNT_CURRENT> (1,775)
33.1

$$$$
WAY-302005
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,776)
1776

>  <Formula> (1,776)
C17H17BrN2O4

>  <MolWeight> (1,776)
393.23188

>  <PCAT_CMPD_ID> (1,776)
WAY-302005

>  <CNC_ID> (1,776)
359382991

>  <transfer_container_id> (1,776)
PTN000000071

>  <COMPOUND_NUMBER> (1,776)
WAY-302005

>  <BAR_CODE_NO> (1,776)
3904563

>  <LOCATION_CODE> (1,776)
PTNCS

>  <AMOUNT_CURRENT> (1,776)
33.5

$$$$
WAY-302006-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,777)
1777

>  <Formula> (1,777)
C14H19ClN2O

>  <MolWeight> (1,777)
266.76646

>  <PCAT_CMPD_ID> (1,777)
WAY-302006-A

>  <CNC_ID> (1,777)
359382992

>  <transfer_container_id> (1,777)
PTN000000071

>  <COMPOUND_NUMBER> (1,777)
WAY-302006-A

>  <BAR_CODE_NO> (1,777)
3904564

>  <LOCATION_CODE> (1,777)
PTNCS

>  <AMOUNT_CURRENT> (1,777)
33.1

$$$$
WAY-302016-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,778)
1778

>  <Formula> (1,778)
C16H17ClN2O2

>  <MolWeight> (1,778)
304.77138

>  <PCAT_CMPD_ID> (1,778)
WAY-302016-A

>  <CNC_ID> (1,778)
359383002

>  <transfer_container_id> (1,778)
PTN000000071

>  <COMPOUND_NUMBER> (1,778)
WAY-302016-A

>  <BAR_CODE_NO> (1,778)
3904576

>  <LOCATION_CODE> (1,778)
PTNCS

>  <AMOUNT_CURRENT> (1,778)
33.3

$$$$
WAY-302018
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,779)
1779

>  <Formula> (1,779)
C19H20O6

>  <MolWeight> (1,779)
344.3585

>  <PCAT_CMPD_ID> (1,779)
WAY-302018

>  <CNC_ID> (1,779)
359383004

>  <transfer_container_id> (1,779)
PTN000000071

>  <COMPOUND_NUMBER> (1,779)
WAY-302018

>  <BAR_CODE_NO> (1,779)
3904578

>  <LOCATION_CODE> (1,779)
PTNCS

>  <AMOUNT_CURRENT> (1,779)
33.1

$$$$
WAY-302027
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  8 13  1  0  0  0  0
  9 15  1  0  0  0  0
 18 23  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,780)
1780

>  <Formula> (1,780)
C19H12N2O4

>  <MolWeight> (1,780)
332.30958

>  <PCAT_CMPD_ID> (1,780)
WAY-302027

>  <CNC_ID> (1,780)
359383013

>  <transfer_container_id> (1,780)
PTN000000071

>  <COMPOUND_NUMBER> (1,780)
WAY-302027

>  <BAR_CODE_NO> (1,780)
3904589

>  <LOCATION_CODE> (1,780)
PTNCS

>  <AMOUNT_CURRENT> (1,780)
33.3

$$$$
WAY-302057
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
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  3  8  1  0  0  0  0
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 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
 15 18  1  0  0  0  0
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 25 27  2  0  0  0  0
  9 12  2  0  0  0  0
 13 14  2  0  0  0  0
 16 17  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,781)
1781

>  <Formula> (1,781)
C19H14N4O3S

>  <MolWeight> (1,781)
378.40446

>  <PCAT_CMPD_ID> (1,781)
WAY-302057

>  <CNC_ID> (1,781)
359383043

>  <transfer_container_id> (1,781)
PTN000000071

>  <COMPOUND_NUMBER> (1,781)
WAY-302057

>  <BAR_CODE_NO> (1,781)
3904628

>  <LOCATION_CODE> (1,781)
PTNCS

>  <AMOUNT_CURRENT> (1,781)
33.3

$$$$
WAY-302075
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
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 18 20  2  0  0  0  0
  8 11  1  0  0  0  0
 12 13  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,782)
1782

>  <Formula> (1,782)
C16H18N2OS

>  <MolWeight> (1,782)
286.39192

>  <PCAT_CMPD_ID> (1,782)
WAY-302075

>  <CNC_ID> (1,782)
359383061

>  <transfer_container_id> (1,782)
PTN000000071

>  <COMPOUND_NUMBER> (1,782)
WAY-302075

>  <BAR_CODE_NO> (1,782)
3904651

>  <LOCATION_CODE> (1,782)
PTNCS

>  <AMOUNT_CURRENT> (1,782)
33.1

$$$$
WAY-302078
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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 11 15  2  0  0  0  0
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  7  8  2  0  0  0  0
 10 13  1  0  0  0  0
 15 16  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,783)
1783

>  <Formula> (1,783)
C17H12N2O

>  <MolWeight> (1,783)
260.28998

>  <PCAT_CMPD_ID> (1,783)
WAY-302078

>  <CNC_ID> (1,783)
359383064

>  <transfer_container_id> (1,783)
PTN000000071

>  <COMPOUND_NUMBER> (1,783)
WAY-302078

>  <BAR_CODE_NO> (1,783)
3904656

>  <LOCATION_CODE> (1,783)
PTNCS

>  <AMOUNT_CURRENT> (1,783)
29.9

$$$$
WAY-302093
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 21 23  1  0  0  0  0
  8 10  2  0  0  0  0
 18 19  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,784)
1784

>  <Formula> (1,784)
C19H21NO3

>  <MolWeight> (1,784)
311.37494

>  <PCAT_CMPD_ID> (1,784)
WAY-302093

>  <CNC_ID> (1,784)
359383079

>  <transfer_container_id> (1,784)
PTN000000071

>  <COMPOUND_NUMBER> (1,784)
WAY-302093

>  <BAR_CODE_NO> (1,784)
3904675

>  <LOCATION_CODE> (1,784)
PTNCS

>  <AMOUNT_CURRENT> (1,784)
33

$$$$
WAY-302120
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,785)
1785

>  <Formula> (1,785)
C16H18N2

>  <MolWeight> (1,785)
238.32752

>  <PCAT_CMPD_ID> (1,785)
WAY-302120

>  <CNC_ID> (1,785)
359383106

>  <transfer_container_id> (1,785)
PTN000000071

>  <COMPOUND_NUMBER> (1,785)
WAY-302120

>  <BAR_CODE_NO> (1,785)
3904707

>  <LOCATION_CODE> (1,785)
PTNCS

>  <AMOUNT_CURRENT> (1,785)
33.4

$$$$
WAY-302124
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,786)
1786

>  <Formula> (1,786)
C10H11N3OS

>  <MolWeight> (1,786)
221.27884

>  <PCAT_CMPD_ID> (1,786)
WAY-302124

>  <CNC_ID> (1,786)
359383110

>  <transfer_container_id> (1,786)
PTN000000071

>  <COMPOUND_NUMBER> (1,786)
WAY-302124

>  <BAR_CODE_NO> (1,786)
3904714

>  <LOCATION_CODE> (1,786)
PTNCS

>  <AMOUNT_CURRENT> (1,786)
33

$$$$
WAY-302130
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,787)
1787

>  <Formula> (1,787)
C12H15NO2

>  <MolWeight> (1,787)
205.253

>  <PCAT_CMPD_ID> (1,787)
WAY-302130

>  <CNC_ID> (1,787)
359383116

>  <transfer_container_id> (1,787)
PTN000000071

>  <COMPOUND_NUMBER> (1,787)
WAY-302130

>  <BAR_CODE_NO> (1,787)
3904720

>  <LOCATION_CODE> (1,787)
PTNCS

>  <AMOUNT_CURRENT> (1,787)
33.5

$$$$
WAY-302150
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,788)
1788

>  <Formula> (1,788)
C11H11NO2S2

>  <MolWeight> (1,788)
253.34054

>  <PCAT_CMPD_ID> (1,788)
WAY-302150

>  <CNC_ID> (1,788)
359383136

>  <transfer_container_id> (1,788)
PTN000000071

>  <COMPOUND_NUMBER> (1,788)
WAY-302150

>  <BAR_CODE_NO> (1,788)
3904750

>  <LOCATION_CODE> (1,788)
PTNCS

>  <AMOUNT_CURRENT> (1,788)
33.5

$$$$
WAY-302159
csChFnd80/10111816222D

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 13  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,789)
1789

>  <Formula> (1,789)
C16H11N3O3

>  <MolWeight> (1,789)
293.27684

>  <PCAT_CMPD_ID> (1,789)
WAY-302159

>  <CNC_ID> (1,789)
359383145

>  <transfer_container_id> (1,789)
PTN000000071

>  <COMPOUND_NUMBER> (1,789)
WAY-302159

>  <BAR_CODE_NO> (1,789)
3904759

>  <LOCATION_CODE> (1,789)
PTNCS

>  <AMOUNT_CURRENT> (1,789)
33.2

$$$$
WAY-302161
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,790)
1790

>  <Formula> (1,790)
C12H10ClN3O2

>  <MolWeight> (1,790)
263.6797

>  <PCAT_CMPD_ID> (1,790)
WAY-302161

>  <CNC_ID> (1,790)
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>  <transfer_container_id> (1,790)
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>  <COMPOUND_NUMBER> (1,790)
WAY-302161

>  <BAR_CODE_NO> (1,790)
3904762

>  <LOCATION_CODE> (1,790)
PTNCS

>  <AMOUNT_CURRENT> (1,790)
33.2

$$$$
WAY-302179
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,791)
1791

>  <Formula> (1,791)
C19H16N2O3

>  <MolWeight> (1,791)
320.34194

>  <PCAT_CMPD_ID> (1,791)
WAY-302179

>  <CNC_ID> (1,791)
359383165

>  <transfer_container_id> (1,791)
PTN000000071

>  <COMPOUND_NUMBER> (1,791)
WAY-302179

>  <BAR_CODE_NO> (1,791)
3904791

>  <LOCATION_CODE> (1,791)
PTNCS

>  <AMOUNT_CURRENT> (1,791)
33.4

$$$$
WAY-302186
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,792)
1792

>  <Formula> (1,792)
C13H16N2O2

>  <MolWeight> (1,792)
232.27834

>  <PCAT_CMPD_ID> (1,792)
WAY-302186

>  <CNC_ID> (1,792)
359383172

>  <transfer_container_id> (1,792)
PTN000000071

>  <COMPOUND_NUMBER> (1,792)
WAY-302186

>  <BAR_CODE_NO> (1,792)
3904798

>  <LOCATION_CODE> (1,792)
PTNCS

>  <AMOUNT_CURRENT> (1,792)
33.4

$$$$
WAY-302216
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,793)
1793

>  <Formula> (1,793)
C16H16ClNO

>  <MolWeight> (1,793)
273.75734

>  <PCAT_CMPD_ID> (1,793)
WAY-302216

>  <CNC_ID> (1,793)
359383202

>  <transfer_container_id> (1,793)
PTN000000071

>  <COMPOUND_NUMBER> (1,793)
WAY-302216

>  <BAR_CODE_NO> (1,793)
3904836

>  <LOCATION_CODE> (1,793)
PTNCS

>  <AMOUNT_CURRENT> (1,793)
33.5

$$$$
WAY-302234
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,794)
1794

>  <Formula> (1,794)
C20H21F3N4O2

>  <MolWeight> (1,794)
406.4015496

>  <PCAT_CMPD_ID> (1,794)
WAY-302234

>  <CNC_ID> (1,794)
359383220

>  <transfer_container_id> (1,794)
PTN000000071

>  <COMPOUND_NUMBER> (1,794)
WAY-302234

>  <BAR_CODE_NO> (1,794)
3904855

>  <LOCATION_CODE> (1,794)
PTNCS

>  <AMOUNT_CURRENT> (1,794)
33.2

$$$$
WAY-302260
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,795)
1795

>  <Formula> (1,795)
C23H17N5OS

>  <MolWeight> (1,795)
411.47898

>  <PCAT_CMPD_ID> (1,795)
WAY-302260

>  <CNC_ID> (1,795)
359383246

>  <transfer_container_id> (1,795)
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>  <COMPOUND_NUMBER> (1,795)
WAY-302260

>  <BAR_CODE_NO> (1,795)
3904887

>  <LOCATION_CODE> (1,795)
PTNCS

>  <AMOUNT_CURRENT> (1,795)
33.3

$$$$
WAY-302285
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,796)
1796

>  <Formula> (1,796)
C12H10N6O4

>  <MolWeight> (1,796)
302.2456

>  <PCAT_CMPD_ID> (1,796)
WAY-302285

>  <CNC_ID> (1,796)
359383271

>  <transfer_container_id> (1,796)
PTN000000071

>  <COMPOUND_NUMBER> (1,796)
WAY-302285

>  <BAR_CODE_NO> (1,796)
3904915

>  <LOCATION_CODE> (1,796)
PTNCS

>  <AMOUNT_CURRENT> (1,796)
33.2

$$$$
WAY-302300
csChFnd80/10111816222D

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 12 13  1  0  0  0  0
 17 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,797)
1797

>  <Formula> (1,797)
C15H12ClFN4O2

>  <MolWeight> (1,797)
334.7327832

>  <PCAT_CMPD_ID> (1,797)
WAY-302300

>  <CNC_ID> (1,797)
359383286

>  <transfer_container_id> (1,797)
PTN000000071

>  <COMPOUND_NUMBER> (1,797)
WAY-302300

>  <BAR_CODE_NO> (1,797)
3904931

>  <LOCATION_CODE> (1,797)
PTNCS

>  <AMOUNT_CURRENT> (1,797)
33.2

$$$$
WAY-302304
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,798)
1798

>  <Formula> (1,798)
C25H16O7

>  <MolWeight> (1,798)
428.39034

>  <PCAT_CMPD_ID> (1,798)
WAY-302304

>  <CNC_ID> (1,798)
359383290

>  <transfer_container_id> (1,798)
PTN000000071

>  <COMPOUND_NUMBER> (1,798)
WAY-302304

>  <BAR_CODE_NO> (1,798)
3904935

>  <LOCATION_CODE> (1,798)
PTNCS

>  <AMOUNT_CURRENT> (1,798)
33.2

$$$$
WAY-302668
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,799)
1799

>  <Formula> (1,799)
C12H23NO3

>  <MolWeight> (1,799)
229.31592

>  <PCAT_CMPD_ID> (1,799)
WAY-302668

>  <CNC_ID> (1,799)
359383654

>  <transfer_container_id> (1,799)
PTN000000071

>  <COMPOUND_NUMBER> (1,799)
WAY-302668

>  <BAR_CODE_NO> (1,799)
3905359

>  <LOCATION_CODE> (1,799)
PTNCS

>  <AMOUNT_CURRENT> (1,799)
33.3

$$$$
WAY-302684
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
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 18 21  1  0  0  0  0
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M  END
>  <Mol_ID> (1,800)
1800

>  <Formula> (1,800)
C27H22N2O4

>  <MolWeight> (1,800)
438.47458

>  <PCAT_CMPD_ID> (1,800)
WAY-302684

>  <CNC_ID> (1,800)
359383670

>  <transfer_container_id> (1,800)
PTN000000071

>  <COMPOUND_NUMBER> (1,800)
WAY-302684

>  <BAR_CODE_NO> (1,800)
3905381

>  <LOCATION_CODE> (1,800)
PTNCS

>  <AMOUNT_CURRENT> (1,800)
33.1

$$$$
WAY-302713-A
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,801)
1801

>  <Formula> (1,801)
C16H11N3O4S

>  <MolWeight> (1,801)
341.34124

>  <PCAT_CMPD_ID> (1,801)
WAY-302713-A

>  <CNC_ID> (1,801)
359383699

>  <transfer_container_id> (1,801)
PTN000000071

>  <COMPOUND_NUMBER> (1,801)
WAY-302713-A

>  <BAR_CODE_NO> (1,801)
3905422

>  <LOCATION_CODE> (1,801)
PTNCS

>  <AMOUNT_CURRENT> (1,801)
33.3

$$$$
WAY-302714
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 17 20  1  0  0  0  0
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 21 22  1  0  0  0  0
  6  8  1  0  0  0  0
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,802)
1802

>  <Formula> (1,802)
C16H15NO5

>  <MolWeight> (1,802)
301.294

>  <PCAT_CMPD_ID> (1,802)
WAY-302714

>  <CNC_ID> (1,802)
359383700

>  <transfer_container_id> (1,802)
PTN000000071

>  <COMPOUND_NUMBER> (1,802)
WAY-302714

>  <BAR_CODE_NO> (1,802)
3905423

>  <LOCATION_CODE> (1,802)
PTNCS

>  <AMOUNT_CURRENT> (1,802)
33

$$$$
WAY-302718
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 16  1  0  0  0  0
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 18 22  1  0  0  0  0
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 22 24  1  0  0  0  0
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 16 17  2  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,803)
1803

>  <Formula> (1,803)
C18H17ClN2O2S

>  <MolWeight> (1,803)
360.85778

>  <PCAT_CMPD_ID> (1,803)
WAY-302718

>  <CNC_ID> (1,803)
359383704

>  <transfer_container_id> (1,803)
PTN000000071

>  <COMPOUND_NUMBER> (1,803)
WAY-302718

>  <BAR_CODE_NO> (1,803)
3905427

>  <LOCATION_CODE> (1,803)
PTNCS

>  <AMOUNT_CURRENT> (1,803)
33.3

$$$$
WAY-302737
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  9  2  0  0  0  0
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 13  5  2  0  0  0  0
 14  3  1  0  0  0  0
 15  4  1  0  0  0  0
 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
 18 20  1  0  0  0  0
 19 11  1  0  0  0  0
 12 20  2  0  0  0  0
 16 21  2  0  0  0  0
 22 21  1  0  0  0  0
  4  7  1  0  0  0  0
 18 19  2  0  0  0  0
 22 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,804)
1804

>  <Formula> (1,804)
C15H12N4O3

>  <MolWeight> (1,804)
296.28078

>  <PCAT_CMPD_ID> (1,804)
WAY-302737

>  <CNC_ID> (1,804)
359383723

>  <transfer_container_id> (1,804)
PTN000000071

>  <COMPOUND_NUMBER> (1,804)
WAY-302737

>  <BAR_CODE_NO> (1,804)
3905450

>  <LOCATION_CODE> (1,804)
PTNCS

>  <AMOUNT_CURRENT> (1,804)
33.4

$$$$
WAY-302740
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (1,805)
1805

>  <Formula> (1,805)
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>  <MolWeight> (1,805)
402.44248

>  <PCAT_CMPD_ID> (1,805)
WAY-302740

>  <CNC_ID> (1,805)
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>  <transfer_container_id> (1,805)
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>  <COMPOUND_NUMBER> (1,805)
WAY-302740

>  <BAR_CODE_NO> (1,805)
3905457

>  <LOCATION_CODE> (1,805)
PTNCS

>  <AMOUNT_CURRENT> (1,805)
33.4

$$$$
WAY-302750
csChFnd80/10111816222D

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 10 12  1  0  0  0  0
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M  END
>  <Mol_ID> (1,806)
1806

>  <Formula> (1,806)
C13H13FN2OS

>  <MolWeight> (1,806)
264.3185232

>  <PCAT_CMPD_ID> (1,806)
WAY-302750

>  <CNC_ID> (1,806)
359383736

>  <transfer_container_id> (1,806)
PTN000000071

>  <COMPOUND_NUMBER> (1,806)
WAY-302750

>  <BAR_CODE_NO> (1,806)
3905468

>  <LOCATION_CODE> (1,806)
PTNCS

>  <AMOUNT_CURRENT> (1,806)
33.4

$$$$
WAY-302764
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,807)
1807

>  <Formula> (1,807)
C24H27N3O2

>  <MolWeight> (1,807)
389.49008

>  <PCAT_CMPD_ID> (1,807)
WAY-302764

>  <CNC_ID> (1,807)
359383750

>  <transfer_container_id> (1,807)
PTN000000071

>  <COMPOUND_NUMBER> (1,807)
WAY-302764

>  <BAR_CODE_NO> (1,807)
3905485

>  <LOCATION_CODE> (1,807)
PTNCS

>  <AMOUNT_CURRENT> (1,807)
33.3

$$$$
WAY-302777
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 20 24  1  0  0  0  0
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 13 15  2  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,808)
1808

>  <Formula> (1,808)
C16H15N3O4S

>  <MolWeight> (1,808)
345.373

>  <PCAT_CMPD_ID> (1,808)
WAY-302777

>  <CNC_ID> (1,808)
359383763

>  <transfer_container_id> (1,808)
PTN000000071

>  <COMPOUND_NUMBER> (1,808)
WAY-302777

>  <BAR_CODE_NO> (1,808)
3905499

>  <LOCATION_CODE> (1,808)
PTNCS

>  <AMOUNT_CURRENT> (1,808)
33.3

$$$$
WAY-302805
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,809)
1809

>  <Formula> (1,809)
C20H18ClF3N4O

>  <MolWeight> (1,809)
422.8313296

>  <PCAT_CMPD_ID> (1,809)
WAY-302805

>  <CNC_ID> (1,809)
359383791

>  <transfer_container_id> (1,809)
PTN000000071

>  <COMPOUND_NUMBER> (1,809)
WAY-302805

>  <BAR_CODE_NO> (1,809)
3905539

>  <LOCATION_CODE> (1,809)
PTNCS

>  <AMOUNT_CURRENT> (1,809)
33.1

$$$$
WAY-302815
csChFnd80/10111816222D

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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  5  8  1  0  0  0  0
 14 16  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,810)
1810

>  <Formula> (1,810)
C14H15NO2S3

>  <MolWeight> (1,810)
325.4694

>  <PCAT_CMPD_ID> (1,810)
WAY-302815

>  <CNC_ID> (1,810)
359383801

>  <transfer_container_id> (1,810)
PTN000000071

>  <COMPOUND_NUMBER> (1,810)
WAY-302815

>  <BAR_CODE_NO> (1,810)
3905549

>  <LOCATION_CODE> (1,810)
PTNCS

>  <AMOUNT_CURRENT> (1,810)
33.3

$$$$
WAY-302845
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  4 10  2  0  0  0  0
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 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
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 20 22  1  0  0  0  0
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 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  6  9  1  0  0  0  0
  7 11  2  0  0  0  0
 10 14  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,811)
1811

>  <Formula> (1,811)
C20H18N2O4

>  <MolWeight> (1,811)
350.36792

>  <PCAT_CMPD_ID> (1,811)
WAY-302845

>  <CNC_ID> (1,811)
359383831

>  <transfer_container_id> (1,811)
PTN000000071

>  <COMPOUND_NUMBER> (1,811)
WAY-302845

>  <BAR_CODE_NO> (1,811)
3905580

>  <LOCATION_CODE> (1,811)
PTNCS

>  <AMOUNT_CURRENT> (1,811)
33.3

$$$$
WAY-302846
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  4  1  0  0  0  0
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  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
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 10  2  2  0  0  0  0
 11 17  2  0  0  0  0
 12  6  1  0  0  0  0
 13 18  2  0  0  0  0
 14  7  2  0  0  0  0
 15  8  1  0  0  0  0
 16  4  1  0  0  0  0
 17 20  1  0  0  0  0
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 19  5  1  0  0  0  0
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 21  9  1  0  0  0  0
 22 20  2  0  0  0  0
 23 11  1  0  0  0  0
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 25 19  2  0  0  0  0
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 27 23  1  0  0  0  0
 28 24  1  0  0  0  0
  3  6  1  0  0  0  0
 12 15  1  0  0  0  0
 12 26  2  0  0  0  0
 11 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,812)
1812

>  <Formula> (1,812)
C21H20N2O5

>  <MolWeight> (1,812)
380.3939

>  <PCAT_CMPD_ID> (1,812)
WAY-302846

>  <CNC_ID> (1,812)
359383832

>  <transfer_container_id> (1,812)
PTN000000071

>  <COMPOUND_NUMBER> (1,812)
WAY-302846

>  <BAR_CODE_NO> (1,812)
3905581

>  <LOCATION_CODE> (1,812)
PTNCS

>  <AMOUNT_CURRENT> (1,812)
33.3

$$$$
WAY-302847
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  8  1  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
 16  9  1  0  0  0  0
 17 16  1  0  0  0  0
 18 21  1  0  0  0  0
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 23 15  2  0  0  0  0
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  3  6  1  0  0  0  0
 11 13  1  0  0  0  0
 24 11  2  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,813)
1813

>  <Formula> (1,813)
C20H18N2O3

>  <MolWeight> (1,813)
334.36852

>  <PCAT_CMPD_ID> (1,813)
WAY-302847

>  <CNC_ID> (1,813)
359383833

>  <transfer_container_id> (1,813)
PTN000000071

>  <COMPOUND_NUMBER> (1,813)
WAY-302847

>  <BAR_CODE_NO> (1,813)
3905582

>  <LOCATION_CODE> (1,813)
PTNCS

>  <AMOUNT_CURRENT> (1,813)
33.5

$$$$
WAY-302848
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  3  1  0  0  0  0
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 13  5  1  0  0  0  0
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 15  6  1  0  0  0  0
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 22  8  1  0  0  0  0
 23 10  1  0  0  0  0
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  7  6  1  0  0  0  0
  8 10  2  0  0  0  0
 20 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,814)
1814

>  <Formula> (1,814)
C19H11ClN2O3

>  <MolWeight> (1,814)
350.75524

>  <PCAT_CMPD_ID> (1,814)
WAY-302848

>  <CNC_ID> (1,814)
359383834

>  <transfer_container_id> (1,814)
PTN000000071

>  <COMPOUND_NUMBER> (1,814)
WAY-302848

>  <BAR_CODE_NO> (1,814)
3905583

>  <LOCATION_CODE> (1,814)
PTNCS

>  <AMOUNT_CURRENT> (1,814)
33.2

$$$$
WAY-302870
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  8 12  1  0  0  0  0
 11 13  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,815)
1815

>  <Formula> (1,815)
C21H26FN3O3

>  <MolWeight> (1,815)
387.4478432

>  <PCAT_CMPD_ID> (1,815)
WAY-302870

>  <CNC_ID> (1,815)
359383856

>  <transfer_container_id> (1,815)
PTN000000071

>  <COMPOUND_NUMBER> (1,815)
WAY-302870

>  <BAR_CODE_NO> (1,815)
3905609

>  <LOCATION_CODE> (1,815)
PTNCS

>  <AMOUNT_CURRENT> (1,815)
33.4

$$$$
WAY-302879
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  5 10  1  0  0  0  0
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 13 16  1  0  0  0  0
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 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
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 21 22  1  0  0  0  0
  9 10  2  0  0  0  0
 14 16  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,816)
1816

>  <Formula> (1,816)
C19H15N3

>  <MolWeight> (1,816)
285.3425

>  <PCAT_CMPD_ID> (1,816)
WAY-302879

>  <CNC_ID> (1,816)
359383865

>  <transfer_container_id> (1,816)
PTN000000071

>  <COMPOUND_NUMBER> (1,816)
WAY-302879

>  <BAR_CODE_NO> (1,816)
3905618

>  <LOCATION_CODE> (1,816)
PTNCS

>  <AMOUNT_CURRENT> (1,816)
33.4

$$$$
WAY-302888
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 13 17  2  0  0  0  0
 14 18  1  0  0  0  0
 18 19  2  0  0  0  0
  5  7  1  0  0  0  0
  9 13  1  0  0  0  0
 12 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,817)
1817

>  <Formula> (1,817)
C14H16N2OS2

>  <MolWeight> (1,817)
292.41964

>  <PCAT_CMPD_ID> (1,817)
WAY-302888

>  <CNC_ID> (1,817)
359383874

>  <transfer_container_id> (1,817)
PTN000000071

>  <COMPOUND_NUMBER> (1,817)
WAY-302888

>  <BAR_CODE_NO> (1,817)
3905630

>  <LOCATION_CODE> (1,817)
PTNCS

>  <AMOUNT_CURRENT> (1,817)
33.2

$$$$
WAY-302914
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 24 27  2  0  0  0  0
  7  9  1  0  0  0  0
 11 14  1  0  0  0  0
 23 26  2  0  0  0  0
 25 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,818)
1818

>  <Formula> (1,818)
C22H25N3O2

>  <MolWeight> (1,818)
363.4528

>  <PCAT_CMPD_ID> (1,818)
WAY-302914

>  <CNC_ID> (1,818)
359383900

>  <transfer_container_id> (1,818)
PTN000000071

>  <COMPOUND_NUMBER> (1,818)
WAY-302914

>  <BAR_CODE_NO> (1,818)
3905662

>  <LOCATION_CODE> (1,818)
PTNCS

>  <AMOUNT_CURRENT> (1,818)
33.3

$$$$
WAY-302934
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
  9 11  2  0  0  0  0
 18 20  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,819)
1819

>  <Formula> (1,819)
C15H16ClN3O3S2

>  <MolWeight> (1,819)
385.88884

>  <PCAT_CMPD_ID> (1,819)
WAY-302934

>  <CNC_ID> (1,819)
359383920

>  <transfer_container_id> (1,819)
PTN000000071

>  <COMPOUND_NUMBER> (1,819)
WAY-302934

>  <BAR_CODE_NO> (1,819)
3905691

>  <LOCATION_CODE> (1,819)
PTNCS

>  <AMOUNT_CURRENT> (1,819)
33.2

$$$$
WAY-302968
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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 10  9  1  0  0  0  0
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 12  8  2  0  0  0  0
 13  7  2  0  0  0  0
 14  6  2  0  0  0  0
 15  2  1  0  0  0  0
 16 11  1  0  0  0  0
 17  8  1  0  0  0  0
 18 10  1  0  0  0  0
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 22 13  1  0  0  0  0
 23 16  1  0  0  0  0
  3  5  2  0  0  0  0
 12 13  1  0  0  0  0
 16 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,820)
1820

>  <Formula> (1,820)
C18H19N3OS

>  <MolWeight> (1,820)
325.42796

>  <PCAT_CMPD_ID> (1,820)
WAY-302968

>  <CNC_ID> (1,820)
359383954

>  <transfer_container_id> (1,820)
PTN000000071

>  <COMPOUND_NUMBER> (1,820)
WAY-302968

>  <BAR_CODE_NO> (1,820)
3905737

>  <LOCATION_CODE> (1,820)
PTNCS

>  <AMOUNT_CURRENT> (1,820)
30

$$$$
WAY-302969
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  4 10  1  0  0  0  0
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 10 15  1  0  0  0  0
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 11 17  1  0  0  0  0
 13 18  1  0  0  0  0
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 15 20  2  0  0  0  0
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 18 22  2  0  0  0  0
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 21 24  2  0  0  0  0
 22 25  1  0  0  0  0
 23 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 12 17  2  0  0  0  0
 19 22  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,821)
1821

>  <Formula> (1,821)
C23H22O4S

>  <MolWeight> (1,821)
394.48338

>  <PCAT_CMPD_ID> (1,821)
WAY-302969

>  <CNC_ID> (1,821)
359383955

>  <transfer_container_id> (1,821)
PTN000000071

>  <COMPOUND_NUMBER> (1,821)
WAY-302969

>  <BAR_CODE_NO> (1,821)
3905738

>  <LOCATION_CODE> (1,821)
PTNCS

>  <AMOUNT_CURRENT> (1,821)
33.3

$$$$
WAY-302973
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  7  9  2  0  0  0  0
 12 14  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,822)
1822

>  <Formula> (1,822)
C16H13BrN4O2S

>  <MolWeight> (1,822)
405.26902

>  <PCAT_CMPD_ID> (1,822)
WAY-302973

>  <CNC_ID> (1,822)
359383959

>  <transfer_container_id> (1,822)
PTN000000071

>  <COMPOUND_NUMBER> (1,822)
WAY-302973

>  <BAR_CODE_NO> (1,822)
3905744

>  <LOCATION_CODE> (1,822)
PTNCS

>  <AMOUNT_CURRENT> (1,822)
33.1

$$$$
WAY-302979
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 25 27  1  0  0  0  0
  7  9  2  0  0  0  0
 12 14  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,823)
1823

>  <Formula> (1,823)
C18H17N5O3S

>  <MolWeight> (1,823)
383.42428

>  <PCAT_CMPD_ID> (1,823)
WAY-302979

>  <CNC_ID> (1,823)
359383965

>  <transfer_container_id> (1,823)
PTN000000071

>  <COMPOUND_NUMBER> (1,823)
WAY-302979

>  <BAR_CODE_NO> (1,823)
3905751

>  <LOCATION_CODE> (1,823)
PTNCS

>  <AMOUNT_CURRENT> (1,823)
33.1

$$$$
WAY-302981
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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 10 15  2  0  0  0  0
 14 16  1  0  0  0  0
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 17 20  1  0  0  0  0
 17 21  1  0  0  0  0
  7  9  2  0  0  0  0
 11 15  1  0  0  0  0
M  END
>  <Mol_ID> (1,824)
1824

>  <Formula> (1,824)
C15H19N3O2S

>  <MolWeight> (1,824)
305.39526

>  <PCAT_CMPD_ID> (1,824)
WAY-302981

>  <CNC_ID> (1,824)
359383967

>  <transfer_container_id> (1,824)
PTN000000071

>  <COMPOUND_NUMBER> (1,824)
WAY-302981

>  <BAR_CODE_NO> (1,824)
3905754

>  <LOCATION_CODE> (1,824)
PTNCS

>  <AMOUNT_CURRENT> (1,824)
33

$$$$
WAY-302990
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,825)
1825

>  <Formula> (1,825)
C14H13BrN2O2S

>  <MolWeight> (1,825)
353.23422

>  <PCAT_CMPD_ID> (1,825)
WAY-302990

>  <CNC_ID> (1,825)
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>  <transfer_container_id> (1,825)
PTN000000071

>  <COMPOUND_NUMBER> (1,825)
WAY-302990

>  <BAR_CODE_NO> (1,825)
3905764

>  <LOCATION_CODE> (1,825)
PTNCS

>  <AMOUNT_CURRENT> (1,825)
33.5

$$$$
WAY-302997
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,826)
1826

>  <Formula> (1,826)
C24H21NO5

>  <MolWeight> (1,826)
403.42724

>  <PCAT_CMPD_ID> (1,826)
WAY-302997

>  <CNC_ID> (1,826)
359383983

>  <transfer_container_id> (1,826)
PTN000000071

>  <COMPOUND_NUMBER> (1,826)
WAY-302997

>  <BAR_CODE_NO> (1,826)
3905771

>  <LOCATION_CODE> (1,826)
PTNCS

>  <AMOUNT_CURRENT> (1,826)
33.1

$$$$
WAY-303009
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,827)
1827

>  <Formula> (1,827)
C9H8N2O2S

>  <MolWeight> (1,827)
208.23702

>  <PCAT_CMPD_ID> (1,827)
WAY-303009

>  <CNC_ID> (1,827)
359383995

>  <transfer_container_id> (1,827)
PTN000000071

>  <COMPOUND_NUMBER> (1,827)
WAY-303009

>  <BAR_CODE_NO> (1,827)
3905784

>  <LOCATION_CODE> (1,827)
PTNCS

>  <AMOUNT_CURRENT> (1,827)
33.4

$$$$
WAY-303013
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,828)
1828

>  <Formula> (1,828)
C18H13Cl2F3N4O2

>  <MolWeight> (1,828)
445.2226296

>  <PCAT_CMPD_ID> (1,828)
WAY-303013

>  <CNC_ID> (1,828)
359383999

>  <transfer_container_id> (1,828)
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>  <COMPOUND_NUMBER> (1,828)
WAY-303013

>  <BAR_CODE_NO> (1,828)
3905789

>  <LOCATION_CODE> (1,828)
PTNCS

>  <AMOUNT_CURRENT> (1,828)
33.4

$$$$
WAY-303049
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1,829)
1829

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>  <COMPOUND_NUMBER> (1,829)
WAY-303049

>  <BAR_CODE_NO> (1,829)
3905828

>  <LOCATION_CODE> (1,829)
PTNCS

>  <AMOUNT_CURRENT> (1,829)
33.5

$$$$
WAY-303052
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  9  7  1  0  0  0  0
 10  3  2  0  0  0  0
 11  2  1  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14 20  1  0  0  0  0
 15  4  1  0  0  0  0
 16  5  1  0  0  0  0
 17  9  1  0  0  0  0
 18  9  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
 21 13  1  0  0  0  0
 22 13  2  0  0  0  0
 23 24  1  0  0  0  0
 24 16  2  0  0  0  0
 25 21  2  0  0  0  0
 26 22  1  0  0  0  0
 27 26  2  0  0  0  0
  4  2  1  0  0  0  0
 19 14  1  0  0  0  0
 23 15  2  0  0  0  0
 27 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,830)
1830

>  <Formula> (1,830)
C21H22N2O4

>  <MolWeight> (1,830)
366.41038

>  <PCAT_CMPD_ID> (1,830)
WAY-303052

>  <CNC_ID> (1,830)
359384037

>  <transfer_container_id> (1,830)
PTN000000071

>  <COMPOUND_NUMBER> (1,830)
WAY-303052

>  <BAR_CODE_NO> (1,830)
3905831

>  <LOCATION_CODE> (1,830)
PTNCS

>  <AMOUNT_CURRENT> (1,830)
33.3

$$$$
WAY-303146
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  3  1  0  0  0  0
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  5 10  1  0  0  0  0
  8 11  1  0  0  0  0
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  8 13  1  0  0  0  0
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 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  1  0  0  0  0
 15 19  2  0  0  0  0
 16 20  1  0  0  0  0
 18 21  2  0  0  0  0
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 21 25  1  0  0  0  0
 25 26  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
 22 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,831)
1831

>  <Formula> (1,831)
C17H18BrF3N4O

>  <MolWeight> (1,831)
431.2502296

>  <PCAT_CMPD_ID> (1,831)
WAY-303146

>  <CNC_ID> (1,831)
359384130

>  <transfer_container_id> (1,831)
PTN000000071

>  <COMPOUND_NUMBER> (1,831)
WAY-303146

>  <BAR_CODE_NO> (1,831)
3905942

>  <LOCATION_CODE> (1,831)
PTNCS

>  <AMOUNT_CURRENT> (1,831)
33.3

$$$$
WAY-303153
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 18 21  2  0  0  0  0
  7  9  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,832)
1832

>  <Formula> (1,832)
C14H14N2O4S

>  <MolWeight> (1,832)
306.33696

>  <PCAT_CMPD_ID> (1,832)
WAY-303153

>  <CNC_ID> (1,832)
359384137

>  <transfer_container_id> (1,832)
PTN000000071

>  <COMPOUND_NUMBER> (1,832)
WAY-303153

>  <BAR_CODE_NO> (1,832)
3905951

>  <LOCATION_CODE> (1,832)
PTNCS

>  <AMOUNT_CURRENT> (1,832)
33.4

$$$$
WAY-303159
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 15  2  0  0  0  0
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 13 18  1  0  0  0  0
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 22 25  2  0  0  0  0
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 10 14  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,833)
1833

>  <Formula> (1,833)
C20H22N2O3

>  <MolWeight> (1,833)
338.40028

>  <PCAT_CMPD_ID> (1,833)
WAY-303159

>  <CNC_ID> (1,833)
359384143

>  <transfer_container_id> (1,833)
PTN000000071

>  <COMPOUND_NUMBER> (1,833)
WAY-303159

>  <BAR_CODE_NO> (1,833)
3905959

>  <LOCATION_CODE> (1,833)
PTNCS

>  <AMOUNT_CURRENT> (1,833)
33

$$$$
WAY-303168
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 12 17  2  0  0  0  0
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 16 20  2  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  6  9  1  0  0  0  0
 10 15  2  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,834)
1834

>  <Formula> (1,834)
C18H20N4OS

>  <MolWeight> (1,834)
340.4426

>  <PCAT_CMPD_ID> (1,834)
WAY-303168

>  <CNC_ID> (1,834)
359384152

>  <transfer_container_id> (1,834)
PTN000000071

>  <COMPOUND_NUMBER> (1,834)
WAY-303168

>  <BAR_CODE_NO> (1,834)
3905974

>  <LOCATION_CODE> (1,834)
PTNCS

>  <AMOUNT_CURRENT> (1,834)
33

$$$$
WAY-303233
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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 13 15  1  0  0  0  0
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  9 11  1  0  0  0  0
 15 16  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,835)
1835

>  <Formula> (1,835)
C19H19ClN2O4

>  <MolWeight> (1,835)
374.81816

>  <PCAT_CMPD_ID> (1,835)
WAY-303233

>  <CNC_ID> (1,835)
359384217

>  <transfer_container_id> (1,835)
PTN000000071

>  <COMPOUND_NUMBER> (1,835)
WAY-303233

>  <BAR_CODE_NO> (1,835)
3906059

>  <LOCATION_CODE> (1,835)
PTNCS

>  <AMOUNT_CURRENT> (1,835)
33.3

$$$$
WAY-303268-A
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  5  1  0  0  0  0
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 10 11  1  0  0  0  0
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 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
  5  6  2  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,836)
1836

>  <Formula> (1,836)
C12H17NO3

>  <MolWeight> (1,836)
223.26828

>  <PCAT_CMPD_ID> (1,836)
WAY-303268-A

>  <CNC_ID> (1,836)
359384252

>  <transfer_container_id> (1,836)
PTN000000071

>  <COMPOUND_NUMBER> (1,836)
WAY-303268-A

>  <BAR_CODE_NO> (1,836)
3906099

>  <LOCATION_CODE> (1,836)
PTNCS

>  <AMOUNT_CURRENT> (1,836)
33.5

$$$$
WAY-303273
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.9278   -0.1791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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  5  9  2  0  0  0  0
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 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,837)
1837

>  <Formula> (1,837)
C15H15NO2S

>  <MolWeight> (1,837)
273.3501

>  <PCAT_CMPD_ID> (1,837)
WAY-303273

>  <CNC_ID> (1,837)
359384257

>  <transfer_container_id> (1,837)
PTN000000071

>  <COMPOUND_NUMBER> (1,837)
WAY-303273

>  <BAR_CODE_NO> (1,837)
3906105

>  <LOCATION_CODE> (1,837)
PTNCS

>  <AMOUNT_CURRENT> (1,837)
33.2

$$$$
WAY-303286
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  8 10  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,838)
1838

>  <Formula> (1,838)
C15H13NO5

>  <MolWeight> (1,838)
287.26742

>  <PCAT_CMPD_ID> (1,838)
WAY-303286

>  <CNC_ID> (1,838)
359384270

>  <transfer_container_id> (1,838)
PTN000000071

>  <COMPOUND_NUMBER> (1,838)
WAY-303286

>  <BAR_CODE_NO> (1,838)
3906121

>  <LOCATION_CODE> (1,838)
PTNCS

>  <AMOUNT_CURRENT> (1,838)
33.3

$$$$
WAY-303290
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 18 20  1  0  0  0  0
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  9 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,839)
1839

>  <Formula> (1,839)
C15H11ClN2OS

>  <MolWeight> (1,839)
302.77864

>  <PCAT_CMPD_ID> (1,839)
WAY-303290

>  <CNC_ID> (1,839)
359384274

>  <transfer_container_id> (1,839)
PTN000000071

>  <COMPOUND_NUMBER> (1,839)
WAY-303290

>  <BAR_CODE_NO> (1,839)
3906129

>  <LOCATION_CODE> (1,839)
PTNCS

>  <AMOUNT_CURRENT> (1,839)
33.2

$$$$
WAY-303292
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,840)
1840

>  <Formula> (1,840)
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>  <MolWeight> (1,840)
277.29574

>  <PCAT_CMPD_ID> (1,840)
WAY-303292

>  <CNC_ID> (1,840)
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>  <transfer_container_id> (1,840)
PTN000000071

>  <COMPOUND_NUMBER> (1,840)
WAY-303292

>  <BAR_CODE_NO> (1,840)
3906131

>  <LOCATION_CODE> (1,840)
PTNCS

>  <AMOUNT_CURRENT> (1,840)
33.4

$$$$
WAY-303305
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,841)
1841

>  <Formula> (1,841)
C19H22N2O3S

>  <MolWeight> (1,841)
358.45458

>  <PCAT_CMPD_ID> (1,841)
WAY-303305

>  <CNC_ID> (1,841)
359384289

>  <transfer_container_id> (1,841)
PTN000000071

>  <COMPOUND_NUMBER> (1,841)
WAY-303305

>  <BAR_CODE_NO> (1,841)
3906149

>  <LOCATION_CODE> (1,841)
PTNCS

>  <AMOUNT_CURRENT> (1,841)
33.5

$$$$
WAY-303308
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (1,842)
1842

>  <Formula> (1,842)
C22H26N4O4

>  <MolWeight> (1,842)
410.46624

>  <PCAT_CMPD_ID> (1,842)
WAY-303308

>  <CNC_ID> (1,842)
359384292

>  <transfer_container_id> (1,842)
PTN000000071

>  <COMPOUND_NUMBER> (1,842)
WAY-303308

>  <BAR_CODE_NO> (1,842)
3906155

>  <LOCATION_CODE> (1,842)
PTNCS

>  <AMOUNT_CURRENT> (1,842)
33.2

$$$$
WAY-303313
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
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M  END
>  <Mol_ID> (1,843)
1843

>  <Formula> (1,843)
C19H15N3O4S

>  <MolWeight> (1,843)
381.4051

>  <PCAT_CMPD_ID> (1,843)
WAY-303313

>  <CNC_ID> (1,843)
359384297

>  <transfer_container_id> (1,843)
PTN000000071

>  <COMPOUND_NUMBER> (1,843)
WAY-303313

>  <BAR_CODE_NO> (1,843)
3906162

>  <LOCATION_CODE> (1,843)
PTNCS

>  <AMOUNT_CURRENT> (1,843)
33.3

$$$$
WAY-304763
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,844)
1844

>  <Formula> (1,844)
C15H10BrNO3

>  <MolWeight> (1,844)
332.1488

>  <PCAT_CMPD_ID> (1,844)
WAY-304763

>  <CNC_ID> (1,844)
359395943

>  <transfer_container_id> (1,844)
PTN000000072

>  <COMPOUND_NUMBER> (1,844)
WAY-304763

>  <BAR_CODE_NO> (1,844)
3907911

>  <LOCATION_CODE> (1,844)
PTNCS

>  <AMOUNT_CURRENT> (1,844)
33.2

$$$$
WAY-304800-A
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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   -0.3793    2.7138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
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  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
 17 18  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,845)
1845

>  <Formula> (1,845)
C15H13N3O2S

>  <MolWeight> (1,845)
299.34762

>  <PCAT_CMPD_ID> (1,845)
WAY-304800-A

>  <CNC_ID> (1,845)
359395979

>  <transfer_container_id> (1,845)
PTN000000072

>  <COMPOUND_NUMBER> (1,845)
WAY-304800-A

>  <BAR_CODE_NO> (1,845)
3907952

>  <LOCATION_CODE> (1,845)
PTNCS

>  <AMOUNT_CURRENT> (1,845)
33.5

$$$$
WAY-304810
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  1  0  0  0  0
 19 20  1  0  0  0  0
  5  8  1  0  0  0  0
 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,846)
1846

>  <Formula> (1,846)
C15H17NO4

>  <MolWeight> (1,846)
275.29978

>  <PCAT_CMPD_ID> (1,846)
WAY-304810

>  <CNC_ID> (1,846)
359395989

>  <transfer_container_id> (1,846)
PTN000000072

>  <COMPOUND_NUMBER> (1,846)
WAY-304810

>  <BAR_CODE_NO> (1,846)
3907962

>  <LOCATION_CODE> (1,846)
PTNCS

>  <AMOUNT_CURRENT> (1,846)
33.9

$$$$
WAY-304818
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   -0.2934    3.4210    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  4 10  1  0  0  0  0
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  6 12  1  0  0  0  0
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  7 14  2  0  0  0  0
 10 15  1  0  0  0  0
 10 16  2  0  0  0  0
 11 17  1  0  0  0  0
 13 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 12 17  1  0  0  0  0
 19 21  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,847)
1847

>  <Formula> (1,847)
C17H23FN2O3S

>  <MolWeight> (1,847)
354.4395232

>  <PCAT_CMPD_ID> (1,847)
WAY-304818

>  <CNC_ID> (1,847)
359395997

>  <transfer_container_id> (1,847)
PTN000000072

>  <COMPOUND_NUMBER> (1,847)
WAY-304818

>  <BAR_CODE_NO> (1,847)
3907972

>  <LOCATION_CODE> (1,847)
PTNCS

>  <AMOUNT_CURRENT> (1,847)
33.4

$$$$
WAY-304840
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
   -2.3414    1.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  2  0  0  0  0
 11 15  1  0  0  0  0
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 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 20 22  2  0  0  0  0
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 22 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 14 17  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,848)
1848

>  <Formula> (1,848)
C24H24N2O3

>  <MolWeight> (1,848)
388.45896

>  <PCAT_CMPD_ID> (1,848)
WAY-304840

>  <CNC_ID> (1,848)
359396019

>  <transfer_container_id> (1,848)
PTN000000072

>  <COMPOUND_NUMBER> (1,848)
WAY-304840

>  <BAR_CODE_NO> (1,848)
3907996

>  <LOCATION_CODE> (1,848)
PTNCS

>  <AMOUNT_CURRENT> (1,848)
33.2

$$$$
WAY-304852
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
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 17 18  2  0  0  0  0
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 18 20  1  0  0  0  0
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 21 24  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,849)
1849

>  <Formula> (1,849)
C18H17N3O3

>  <MolWeight> (1,849)
323.34588

>  <PCAT_CMPD_ID> (1,849)
WAY-304852

>  <CNC_ID> (1,849)
359396031

>  <transfer_container_id> (1,849)
PTN000000072

>  <COMPOUND_NUMBER> (1,849)
WAY-304852

>  <BAR_CODE_NO> (1,849)
3908011

>  <LOCATION_CODE> (1,849)
PTNCS

>  <AMOUNT_CURRENT> (1,849)
33.2

$$$$
WAY-304871
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,850)
1850

>  <Formula> (1,850)
C15H13N5OS

>  <MolWeight> (1,850)
311.36162

>  <PCAT_CMPD_ID> (1,850)
WAY-304871

>  <CNC_ID> (1,850)
359396050

>  <transfer_container_id> (1,850)
PTN000000072

>  <COMPOUND_NUMBER> (1,850)
WAY-304871

>  <BAR_CODE_NO> (1,850)
3908033

>  <LOCATION_CODE> (1,850)
PTNCS

>  <AMOUNT_CURRENT> (1,850)
33.6

$$$$
WAY-304975
csChFnd80/10111816222D

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  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,851)
1851

>  <Formula> (1,851)
C16H13FN2OS

>  <MolWeight> (1,851)
300.3506232

>  <PCAT_CMPD_ID> (1,851)
WAY-304975

>  <CNC_ID> (1,851)
359396152

>  <transfer_container_id> (1,851)
PTN000000072

>  <COMPOUND_NUMBER> (1,851)
WAY-304975

>  <BAR_CODE_NO> (1,851)
3908156

>  <LOCATION_CODE> (1,851)
PTNCS

>  <AMOUNT_CURRENT> (1,851)
33.5

$$$$
WAY-305006
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  7 10  1  0  0  0  0
 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,852)
1852

>  <Formula> (1,852)
C16H20N2OS

>  <MolWeight> (1,852)
288.4078

>  <PCAT_CMPD_ID> (1,852)
WAY-305006

>  <CNC_ID> (1,852)
359396183

>  <transfer_container_id> (1,852)
PTN000000072

>  <COMPOUND_NUMBER> (1,852)
WAY-305006

>  <BAR_CODE_NO> (1,852)
3908193

>  <LOCATION_CODE> (1,852)
PTNCS

>  <AMOUNT_CURRENT> (1,852)
33.6

$$$$
WAY-305016
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
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M  END
>  <Mol_ID> (1,853)
1853

>  <Formula> (1,853)
C20H19N3O5S

>  <MolWeight> (1,853)
413.44696

>  <PCAT_CMPD_ID> (1,853)
WAY-305016

>  <CNC_ID> (1,853)
359396193

>  <transfer_container_id> (1,853)
PTN000000072

>  <COMPOUND_NUMBER> (1,853)
WAY-305016

>  <BAR_CODE_NO> (1,853)
3908206

>  <LOCATION_CODE> (1,853)
PTNCS

>  <AMOUNT_CURRENT> (1,853)
33.5

$$$$
WAY-305048
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 13 12  1  0  0  0  0
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M  END
>  <Mol_ID> (1,854)
1854

>  <Formula> (1,854)
C18H18N2O3S

>  <MolWeight> (1,854)
342.41212

>  <PCAT_CMPD_ID> (1,854)
WAY-305048

>  <CNC_ID> (1,854)
359396225

>  <transfer_container_id> (1,854)
PTN000000072

>  <COMPOUND_NUMBER> (1,854)
WAY-305048

>  <BAR_CODE_NO> (1,854)
3908248

>  <LOCATION_CODE> (1,854)
PTNCS

>  <AMOUNT_CURRENT> (1,854)
33.3

$$$$
WAY-305071
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,855)
1855

>  <Formula> (1,855)
C22H15NO4S2

>  <MolWeight> (1,855)
421.4888

>  <PCAT_CMPD_ID> (1,855)
WAY-305071

>  <CNC_ID> (1,855)
359396248

>  <transfer_container_id> (1,855)
PTN000000072

>  <COMPOUND_NUMBER> (1,855)
WAY-305071

>  <BAR_CODE_NO> (1,855)
3908275

>  <LOCATION_CODE> (1,855)
PTNCS

>  <AMOUNT_CURRENT> (1,855)
33.6

$$$$
WAY-305080
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,856)
1856

>  <Formula> (1,856)
C22H22FN3O4

>  <MolWeight> (1,856)
411.4261832

>  <PCAT_CMPD_ID> (1,856)
WAY-305080

>  <CNC_ID> (1,856)
359396257

>  <transfer_container_id> (1,856)
PTN000000072

>  <COMPOUND_NUMBER> (1,856)
WAY-305080

>  <BAR_CODE_NO> (1,856)
3908285

>  <LOCATION_CODE> (1,856)
PTNCS

>  <AMOUNT_CURRENT> (1,856)
33.5

$$$$
WAY-305082
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,857)
1857

>  <Formula> (1,857)
C17H18N2O3S

>  <MolWeight> (1,857)
330.40142

>  <PCAT_CMPD_ID> (1,857)
WAY-305082

>  <CNC_ID> (1,857)
359396259

>  <transfer_container_id> (1,857)
PTN000000072

>  <COMPOUND_NUMBER> (1,857)
WAY-305082

>  <BAR_CODE_NO> (1,857)
3908287

>  <LOCATION_CODE> (1,857)
PTNCS

>  <AMOUNT_CURRENT> (1,857)
33

$$$$
WAY-305117
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,858)
1858

>  <Formula> (1,858)
C17H21ClF3N3O5S

>  <MolWeight> (1,858)
471.8789496

>  <PCAT_CMPD_ID> (1,858)
WAY-305117

>  <CNC_ID> (1,858)
359396293

>  <transfer_container_id> (1,858)
PTN000000072

>  <COMPOUND_NUMBER> (1,858)
WAY-305117

>  <BAR_CODE_NO> (1,858)
3908333

>  <LOCATION_CODE> (1,858)
PTNCS

>  <AMOUNT_CURRENT> (1,858)
33.5

$$$$
WAY-305133
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (1,859)
1859

>  <Formula> (1,859)
C22H17N3OS2

>  <MolWeight> (1,859)
403.51988

>  <PCAT_CMPD_ID> (1,859)
WAY-305133

>  <CNC_ID> (1,859)
359396309

>  <transfer_container_id> (1,859)
PTN000000072

>  <COMPOUND_NUMBER> (1,859)
WAY-305133

>  <BAR_CODE_NO> (1,859)
3908351

>  <LOCATION_CODE> (1,859)
PTNCS

>  <AMOUNT_CURRENT> (1,859)
33.5

$$$$
WAY-305142-A
csChFnd80/10111816222D

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 11 15  1  0  0  0  0
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  5  9  1  0  0  0  0
 14 16  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,860)
1860

>  <Formula> (1,860)
C16H21FN2OS

>  <MolWeight> (1,860)
308.4141432

>  <PCAT_CMPD_ID> (1,860)
WAY-305142-A

>  <CNC_ID> (1,860)
359396318

>  <transfer_container_id> (1,860)
PTN000000072

>  <COMPOUND_NUMBER> (1,860)
WAY-305142-A

>  <BAR_CODE_NO> (1,860)
3908363

>  <LOCATION_CODE> (1,860)
PTNCS

>  <AMOUNT_CURRENT> (1,860)
33.3

$$$$
WAY-305145-A
csChFnd80/10111816222D

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 10 14  1  0  0  0  0
 13 15  2  0  0  0  0
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  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
 20 22  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,861)
1861

>  <Formula> (1,861)
C23H23N3O2

>  <MolWeight> (1,861)
373.44762

>  <PCAT_CMPD_ID> (1,861)
WAY-305145-A

>  <CNC_ID> (1,861)
359396321

>  <transfer_container_id> (1,861)
PTN000000072

>  <COMPOUND_NUMBER> (1,861)
WAY-305145-A

>  <BAR_CODE_NO> (1,861)
3908366

>  <LOCATION_CODE> (1,861)
PTNCS

>  <AMOUNT_CURRENT> (1,861)
33.1

$$$$
WAY-305160
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 20 23  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,862)
1862

>  <Formula> (1,862)
C16H17N5O2

>  <MolWeight> (1,862)
311.33848

>  <PCAT_CMPD_ID> (1,862)
WAY-305160

>  <CNC_ID> (1,862)
359396336

>  <transfer_container_id> (1,862)
PTN000000072

>  <COMPOUND_NUMBER> (1,862)
WAY-305160

>  <BAR_CODE_NO> (1,862)
3908385

>  <LOCATION_CODE> (1,862)
PTNCS

>  <AMOUNT_CURRENT> (1,862)
33.8

$$$$
WAY-305199
csChFnd80/10111816222D

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  6  7  1  0  0  0  0
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M  END
>  <Mol_ID> (1,863)
1863

>  <Formula> (1,863)
C19H18FN5OS

>  <MolWeight> (1,863)
383.4425232

>  <PCAT_CMPD_ID> (1,863)
WAY-305199

>  <CNC_ID> (1,863)
359396375

>  <transfer_container_id> (1,863)
PTN000000072

>  <COMPOUND_NUMBER> (1,863)
WAY-305199

>  <BAR_CODE_NO> (1,863)
3908432

>  <LOCATION_CODE> (1,863)
PTNCS

>  <AMOUNT_CURRENT> (1,863)
33.3

$$$$
WAY-305315
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 17 18  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (1,864)
1864

>  <Formula> (1,864)
C22H26N2O5

>  <MolWeight> (1,864)
398.45224

>  <PCAT_CMPD_ID> (1,864)
WAY-305315

>  <CNC_ID> (1,864)
359396491

>  <transfer_container_id> (1,864)
PTN000000072

>  <COMPOUND_NUMBER> (1,864)
WAY-305315

>  <BAR_CODE_NO> (1,864)
3908568

>  <LOCATION_CODE> (1,864)
PTNCS

>  <AMOUNT_CURRENT> (1,864)
33.5

$$$$
WAY-305331
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,865)
1865

>  <Formula> (1,865)
C21H17N3O

>  <MolWeight> (1,865)
327.37918

>  <PCAT_CMPD_ID> (1,865)
WAY-305331

>  <CNC_ID> (1,865)
359396507

>  <transfer_container_id> (1,865)
PTN000000072

>  <COMPOUND_NUMBER> (1,865)
WAY-305331

>  <BAR_CODE_NO> (1,865)
3908589

>  <LOCATION_CODE> (1,865)
PTNCS

>  <AMOUNT_CURRENT> (1,865)
33.5

$$$$
WAY-305341
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 20 22  2  0  0  0  0
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 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,866)
1866

>  <Formula> (1,866)
C15H15N3O3S

>  <MolWeight> (1,866)
317.3629

>  <PCAT_CMPD_ID> (1,866)
WAY-305341

>  <CNC_ID> (1,866)
359396517

>  <transfer_container_id> (1,866)
PTN000000072

>  <COMPOUND_NUMBER> (1,866)
WAY-305341

>  <BAR_CODE_NO> (1,866)
3908605

>  <LOCATION_CODE> (1,866)
PTNCS

>  <AMOUNT_CURRENT> (1,866)
33.1

$$$$
WAY-305345
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 17 20  2  0  0  0  0
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M  END
>  <Mol_ID> (1,867)
1867

>  <Formula> (1,867)
C18H15N3O2S2

>  <MolWeight> (1,867)
369.4606

>  <PCAT_CMPD_ID> (1,867)
WAY-305345

>  <CNC_ID> (1,867)
359396521

>  <transfer_container_id> (1,867)
PTN000000072

>  <COMPOUND_NUMBER> (1,867)
WAY-305345

>  <BAR_CODE_NO> (1,867)
3908613

>  <LOCATION_CODE> (1,867)
PTNCS

>  <AMOUNT_CURRENT> (1,867)
33.6

$$$$
WAY-305359
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  2  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (1,868)
1868

>  <Formula> (1,868)
C23H19NO5

>  <MolWeight> (1,868)
389.40066

>  <PCAT_CMPD_ID> (1,868)
WAY-305359

>  <CNC_ID> (1,868)
359396535

>  <transfer_container_id> (1,868)
PTN000000072

>  <COMPOUND_NUMBER> (1,868)
WAY-305359

>  <BAR_CODE_NO> (1,868)
3908630

>  <LOCATION_CODE> (1,868)
PTNCS

>  <AMOUNT_CURRENT> (1,868)
33.8

$$$$
WAY-305377
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  5  9  2  0  0  0  0
 14 18  1  0  0  0  0
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M  END
>  <Mol_ID> (1,869)
1869

>  <Formula> (1,869)
C20H20N2O5S

>  <MolWeight> (1,869)
400.4482

>  <PCAT_CMPD_ID> (1,869)
WAY-305377

>  <CNC_ID> (1,869)
359396554

>  <transfer_container_id> (1,869)
PTN000000072

>  <COMPOUND_NUMBER> (1,869)
WAY-305377

>  <BAR_CODE_NO> (1,869)
3908649

>  <LOCATION_CODE> (1,869)
PTNCS

>  <AMOUNT_CURRENT> (1,869)
33.6

$$$$
WAY-305447
csChFnd80/10111816222D

 32 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,870)
1870

>  <Formula> (1,870)
C23H29N3O5S

>  <MolWeight> (1,870)
459.55846

>  <PCAT_CMPD_ID> (1,870)
WAY-305447

>  <CNC_ID> (1,870)
359396623

>  <transfer_container_id> (1,870)
PTN000000072

>  <COMPOUND_NUMBER> (1,870)
WAY-305447

>  <BAR_CODE_NO> (1,870)
3908723

>  <LOCATION_CODE> (1,870)
PTNCS

>  <AMOUNT_CURRENT> (1,870)
33.8

$$$$
WAY-305460
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,871)
1871

>  <Formula> (1,871)
C19H13F3N4O2

>  <MolWeight> (1,871)
386.3273296

>  <PCAT_CMPD_ID> (1,871)
WAY-305460

>  <CNC_ID> (1,871)
359396636

>  <transfer_container_id> (1,871)
PTN000000072

>  <COMPOUND_NUMBER> (1,871)
WAY-305460

>  <BAR_CODE_NO> (1,871)
3908737

>  <LOCATION_CODE> (1,871)
PTNCS

>  <AMOUNT_CURRENT> (1,871)
33.4

$$$$
WAY-305469
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,872)
1872

>  <Formula> (1,872)
C20H32N2O2

>  <MolWeight> (1,872)
332.48028

>  <PCAT_CMPD_ID> (1,872)
WAY-305469

>  <CNC_ID> (1,872)
359396645

>  <transfer_container_id> (1,872)
PTN000000072

>  <COMPOUND_NUMBER> (1,872)
WAY-305469

>  <BAR_CODE_NO> (1,872)
3908748

>  <LOCATION_CODE> (1,872)
PTNCS

>  <AMOUNT_CURRENT> (1,872)
33.8

$$$$
WAY-383399
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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  4 12  1  0  0  0  0
  9  3  1  0  0  0  0
  6  8  1  0  0  0  0
 21 27  2  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,873)
1873

>  <Formula> (1,873)
C23H17N5O3

>  <MolWeight> (1,873)
411.41278

>  <PCAT_CMPD_ID> (1,873)
WAY-383399

>  <CNC_ID> (1,873)
359399479

>  <transfer_container_id> (1,873)
PTN000000072

>  <COMPOUND_NUMBER> (1,873)
WAY-383399

>  <BAR_CODE_NO> (1,873)
2545614

>  <LOCATION_CODE> (1,873)
PTNCS

>  <AMOUNT_CURRENT> (1,873)
33

$$$$
WAY-383439
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 11  2  2  0  0  0  0
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 15  8  2  0  0  0  0
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 18  7  1  0  0  0  0
 19  7  2  0  0  0  0
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 22  3  2  0  0  0  0
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 26  6  2  0  0  0  0
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 30 27  1  0  0  0  0
 20 23  1  0  0  0  0
 28 22  1  0  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,874)
1874

>  <Formula> (1,874)
C21H23FN2O5S

>  <MolWeight> (1,874)
434.4811232

>  <PCAT_CMPD_ID> (1,874)
WAY-383439

>  <CNC_ID> (1,874)
359399502

>  <transfer_container_id> (1,874)
PTN000000072

>  <COMPOUND_NUMBER> (1,874)
WAY-383439

>  <BAR_CODE_NO> (1,874)
2545835

>  <LOCATION_CODE> (1,874)
PTNCS

>  <AMOUNT_CURRENT> (1,874)
32.9

$$$$
WAY-383810
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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  3  6  1  0  0  0  0
 20 30  1  0  0  0  0
 33 31  2  0  0  0  0
 15  7  1  0  0  0  0
M  END
>  <Mol_ID> (1,875)
1875

>  <Formula> (1,875)
C22H23ClN4O5S

>  <MolWeight> (1,875)
490.95982

>  <PCAT_CMPD_ID> (1,875)
WAY-383810

>  <CNC_ID> (1,875)
359399863

>  <transfer_container_id> (1,875)
PTN000000072

>  <COMPOUND_NUMBER> (1,875)
WAY-383810

>  <BAR_CODE_NO> (1,875)
2545924

>  <LOCATION_CODE> (1,875)
PTNCS

>  <AMOUNT_CURRENT> (1,875)
29.2

$$$$
WAY-383848
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 24 28  2  0  0  0  0
 26 29  1  0  0  0  0
 27 30  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  1  0  0  0  0
 20 21  2  0  0  0  0
 25 28  1  0  0  0  0
 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (1,876)
1876

>  <Formula> (1,876)
C23H15N5O2

>  <MolWeight> (1,876)
393.3975

>  <PCAT_CMPD_ID> (1,876)
WAY-383848

>  <CNC_ID> (1,876)
359399890

>  <transfer_container_id> (1,876)
PTN000000072

>  <COMPOUND_NUMBER> (1,876)
WAY-383848

>  <BAR_CODE_NO> (1,876)
2546132

>  <LOCATION_CODE> (1,876)
PTNCS

>  <AMOUNT_CURRENT> (1,876)
29.7

$$$$
WAY-383858
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  9  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  1  0  0  0  0
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 10  2  1  0  0  0  0
 11  8  1  0  0  0  0
 12  6  1  0  0  0  0
 13 12  1  0  0  0  0
 14  3  2  0  0  0  0
 15  3  2  0  0  0  0
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 17 21  2  0  0  0  0
 18 12  2  0  0  0  0
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 22  3  1  0  0  0  0
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 24  5  1  0  0  0  0
 25  7  1  0  0  0  0
 26 16  1  0  0  0  0
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 28 23  1  0  0  0  0
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 30 25  1  0  0  0  0
  7  5  2  0  0  0  0
 30 29  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,877)
1877

>  <Formula> (1,877)
C21H26N2O5S2

>  <MolWeight> (1,877)
450.57154

>  <PCAT_CMPD_ID> (1,877)
WAY-383858

>  <CNC_ID> (1,877)
359399897

>  <transfer_container_id> (1,877)
PTN000000072

>  <COMPOUND_NUMBER> (1,877)
WAY-383858

>  <BAR_CODE_NO> (1,877)
2546131

>  <LOCATION_CODE> (1,877)
PTNCS

>  <AMOUNT_CURRENT> (1,877)
25.7

$$$$
WAY-383487
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    8.8292    5.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9250    3.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.7042    5.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
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 10 16  1  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  2  0  0  0  0
 14  9  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  2  0  0  0  0
 17  2  1  0  0  0  0
 18  2  1  0  0  0  0
 19 18  1  0  0  0  0
 20 17  1  0  0  0  0
 21 19  1  0  0  0  0
 15 10  2  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,878)
1878

>  <Formula> (1,878)
C16H20FNO3

>  <MolWeight> (1,878)
293.3333032

>  <PCAT_CMPD_ID> (1,878)
WAY-383487

>  <CNC_ID> (1,878)
359399750

>  <transfer_container_id> (1,878)
PTN000000072

>  <COMPOUND_NUMBER> (1,878)
WAY-383487

>  <BAR_CODE_NO> (1,878)
2546231

>  <LOCATION_CODE> (1,878)
PTNCS

>  <AMOUNT_CURRENT> (1,878)
33

$$$$
WAY-383490
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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  4  6  1  0  0  0  0
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  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  5  2  0  0  0  0
 11  8  2  0  0  0  0
 12  6  2  0  0  0  0
 13  9  2  0  0  0  0
 14  7  2  0  0  0  0
 15  3  1  0  0  0  0
 16  2  1  0  0  0  0
 17  4  1  0  0  0  0
 18 20  2  0  0  0  0
 19  9  1  0  0  0  0
 20 11  1  0  0  0  0
 21 18  1  0  0  0  0
  2  5  1  0  0  0  0
 13 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,879)
1879

>  <Formula> (1,879)
C13H11F2N3O3

>  <MolWeight> (1,879)
295.2415464

>  <PCAT_CMPD_ID> (1,879)
WAY-383490

>  <CNC_ID> (1,879)
359400033

>  <transfer_container_id> (1,879)
PTN000000072

>  <COMPOUND_NUMBER> (1,879)
WAY-383490

>  <BAR_CODE_NO> (1,879)
2546234

>  <LOCATION_CODE> (1,879)
PTNCS

>  <AMOUNT_CURRENT> (1,879)
32.5

$$$$
WAY-383515
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 11 16  1  0  0  0  0
 11 17  2  0  0  0  0
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 14 19  1  0  0  0  0
 16 20  1  0  0  0  0
 16 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
 10 13  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,880)
1880

>  <Formula> (1,880)
C17H18N2O3S

>  <MolWeight> (1,880)
330.40142

>  <PCAT_CMPD_ID> (1,880)
WAY-383515

>  <CNC_ID> (1,880)
359399585

>  <transfer_container_id> (1,880)
PTN000000072

>  <COMPOUND_NUMBER> (1,880)
WAY-383515

>  <BAR_CODE_NO> (1,880)
2546358

>  <LOCATION_CODE> (1,880)
PTNCS

>  <AMOUNT_CURRENT> (1,880)
32.5

$$$$
WAY-383645
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 18  9  1  0  0  0  0
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 23  4  1  0  0  0  0
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 11 13  1  0  0  0  0
 28 30  2  0  0  0  0
M  END
>  <Mol_ID> (1,881)
1881

>  <Formula> (1,881)
C24H26N2O3S

>  <MolWeight> (1,881)
422.53984

>  <PCAT_CMPD_ID> (1,881)
WAY-383645

>  <CNC_ID> (1,881)
359399713

>  <transfer_container_id> (1,881)
PTN000000072

>  <COMPOUND_NUMBER> (1,881)
WAY-383645

>  <BAR_CODE_NO> (1,881)
2545883

>  <LOCATION_CODE> (1,881)
PTNCS

>  <AMOUNT_CURRENT> (1,881)
32.5

$$$$
WAY-383705
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  1  2  0  0  0  0
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 10  5  2  0  0  0  0
 11  8  1  0  0  0  0
 12  2  2  0  0  0  0
 13  9  1  0  0  0  0
 14  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16 17  1  0  0  0  0
 17 14  2  0  0  0  0
 18  4  1  0  0  0  0
 19 13  1  0  0  0  0
 20  9  1  0  0  0  0
 21 11  1  0  0  0  0
 22 16  1  0  0  0  0
 23 18  1  0  0  0  0
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  3  5  1  0  0  0  0
 16 11  2  0  0  0  0
 13 15  2  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,882)
1882

>  <Formula> (1,882)
C21H17NO3

>  <MolWeight> (1,882)
331.36458

>  <PCAT_CMPD_ID> (1,882)
WAY-383705

>  <CNC_ID> (1,882)
359399764

>  <transfer_container_id> (1,882)
PTN000000072

>  <COMPOUND_NUMBER> (1,882)
WAY-383705

>  <BAR_CODE_NO> (1,882)
2545949

>  <LOCATION_CODE> (1,882)
PTNCS

>  <AMOUNT_CURRENT> (1,882)
32.3

$$$$
WAY-383715
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  2  1  0  0  0  0
 12  7  1  0  0  0  0
 13 12  1  0  0  0  0
 14 12  2  0  0  0  0
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 16 15  1  0  0  0  0
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 18 13  2  0  0  0  0
 19 14  1  0  0  0  0
 20 19  2  0  0  0  0
  4  2  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (1,883)
1883

>  <Formula> (1,883)
C14H17N3O2S

>  <MolWeight> (1,883)
291.36868

>  <PCAT_CMPD_ID> (1,883)
WAY-383715

>  <CNC_ID> (1,883)
359399771

>  <transfer_container_id> (1,883)
PTN000000072

>  <COMPOUND_NUMBER> (1,883)
WAY-383715

>  <BAR_CODE_NO> (1,883)
2545944

>  <LOCATION_CODE> (1,883)
PTNCS

>  <AMOUNT_CURRENT> (1,883)
32.2

$$$$
WAY-383724
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10 18  1  0  0  0  0
 11 21  1  0  0  0  0
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 18  7  1  0  0  0  0
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 20  8  2  0  0  0  0
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 23  5  2  0  0  0  0
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 29 27  1  0  0  0  0
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M  END
>  <Mol_ID> (1,884)
1884

>  <Formula> (1,884)
C21H16FN3O3S

>  <MolWeight> (1,884)
409.4334432

>  <PCAT_CMPD_ID> (1,884)
WAY-383724

>  <CNC_ID> (1,884)
359399780

>  <transfer_container_id> (1,884)
PTN000000072

>  <COMPOUND_NUMBER> (1,884)
WAY-383724

>  <BAR_CODE_NO> (1,884)
2545775

>  <LOCATION_CODE> (1,884)
PTNCS

>  <AMOUNT_CURRENT> (1,884)
28.8

$$$$
WAY-383733
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  5  7  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,885)
1885

>  <Formula> (1,885)
C15H17NO3S2

>  <MolWeight> (1,885)
323.43038

>  <PCAT_CMPD_ID> (1,885)
WAY-383733

>  <CNC_ID> (1,885)
359399789

>  <transfer_container_id> (1,885)
PTN000000072

>  <COMPOUND_NUMBER> (1,885)
WAY-383733

>  <BAR_CODE_NO> (1,885)
2545763

>  <LOCATION_CODE> (1,885)
PTNCS

>  <AMOUNT_CURRENT> (1,885)
32.5

$$$$
WAY-383864
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 12  6  1  0  0  0  0
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 15  9  1  0  0  0  0
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 17  3  2  0  0  0  0
 18  4  1  0  0  0  0
 19  7  2  0  0  0  0
 20  8  1  0  0  0  0
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 25 20  2  0  0  0  0
 19 26  1  0  0  0  0
 22 16  2  0  0  0  0
M  END
>  <Mol_ID> (1,886)
1886

>  <Formula> (1,886)
C21H15NO3S2

>  <MolWeight> (1,886)
393.4787

>  <PCAT_CMPD_ID> (1,886)
WAY-383864

>  <CNC_ID> (1,886)
359399902

>  <transfer_container_id> (1,886)
PTN000000072

>  <COMPOUND_NUMBER> (1,886)
WAY-383864

>  <BAR_CODE_NO> (1,886)
2545899

>  <LOCATION_CODE> (1,886)
PTNCS

>  <AMOUNT_CURRENT> (1,886)
29.5

$$$$
WAY-383949
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
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 16 18  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,887)
1887

>  <Formula> (1,887)
C13H10N2OS2

>  <MolWeight> (1,887)
274.3613

>  <PCAT_CMPD_ID> (1,887)
WAY-383949

>  <CNC_ID> (1,887)
359399970

>  <transfer_container_id> (1,887)
PTN000000072

>  <COMPOUND_NUMBER> (1,887)
WAY-383949

>  <BAR_CODE_NO> (1,887)
2546012

>  <LOCATION_CODE> (1,887)
PTNCS

>  <AMOUNT_CURRENT> (1,887)
32.2

$$$$
WAY-383985
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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   10.5792   -9.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7 10  1  0  0  0  0
  8  3  1  0  0  0  0
  9  6  1  0  0  0  0
 10 15  2  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13  6  2  0  0  0  0
 14  7  2  0  0  0  0
 15 20  1  0  0  0  0
 16 19  2  0  0  0  0
 17  9  1  0  0  0  0
 18  7  1  0  0  0  0
 19 17  1  0  0  0  0
 20 17  2  0  0  0  0
 21 18  1  0  0  0  0
  4  8  1  0  0  0  0
 10 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,888)
1888

>  <Formula> (1,888)
C13H13N3O5

>  <MolWeight> (1,888)
291.25942

>  <PCAT_CMPD_ID> (1,888)
WAY-383985

>  <CNC_ID> (1,888)
359400005

>  <transfer_container_id> (1,888)
PTN000000072

>  <COMPOUND_NUMBER> (1,888)
WAY-383985

>  <BAR_CODE_NO> (1,888)
2546043

>  <LOCATION_CODE> (1,888)
PTNCS

>  <AMOUNT_CURRENT> (1,888)
32.1

$$$$
WAY-384061
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   12.8000   -8.3667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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  4  1  1  0  0  0  0
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  9  5  2  0  0  0  0
 10  4  1  0  0  0  0
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 13  8  1  0  0  0  0
 14  6  1  0  0  0  0
 15  6  2  0  0  0  0
 16  7  1  0  0  0  0
 17  4  1  0  0  0  0
 18  5  1  0  0  0  0
 19  9  1  0  0  0  0
 20 13  1  0  0  0  0
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 22 21  1  0  0  0  0
  9 10  1  0  0  0  0
 22 19  2  0  0  0  0
  7 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,889)
1889

>  <Formula> (1,889)
C16H17N3O2S

>  <MolWeight> (1,889)
315.39008

>  <PCAT_CMPD_ID> (1,889)
WAY-384061

>  <CNC_ID> (1,889)
359400069

>  <transfer_container_id> (1,889)
PTN000000072

>  <COMPOUND_NUMBER> (1,889)
WAY-384061

>  <BAR_CODE_NO> (1,889)
2546108

>  <LOCATION_CODE> (1,889)
PTNCS

>  <AMOUNT_CURRENT> (1,889)
32.9

$$$$
WAY-384083
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 14  7  1  0  0  0  0
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 22  6  1  0  0  0  0
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 30 24  1  0  0  0  0
 31 26  1  0  0  0  0
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  3  4  2  0  0  0  0
 27 32  1  0  0  0  0
  6 11  1  0  0  0  0
 20 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,890)
1890

>  <Formula> (1,890)
C24H28N4O4

>  <MolWeight> (1,890)
436.50352

>  <PCAT_CMPD_ID> (1,890)
WAY-384083

>  <CNC_ID> (1,890)
359400091

>  <transfer_container_id> (1,890)
PTN000000072

>  <COMPOUND_NUMBER> (1,890)
WAY-384083

>  <BAR_CODE_NO> (1,890)
2546164

>  <LOCATION_CODE> (1,890)
PTNCS

>  <AMOUNT_CURRENT> (1,890)
32.9

$$$$
WAY-384117
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,891)
1891

>  <Formula> (1,891)
C22H17Cl2N3O2

>  <MolWeight> (1,891)
426.29528

>  <PCAT_CMPD_ID> (1,891)
WAY-384117

>  <CNC_ID> (1,891)
359400122

>  <transfer_container_id> (1,891)
PTN000000072

>  <COMPOUND_NUMBER> (1,891)
WAY-384117

>  <BAR_CODE_NO> (1,891)
2546306

>  <LOCATION_CODE> (1,891)
PTNCS

>  <AMOUNT_CURRENT> (1,891)
32.3

$$$$
WAY-384156
csChFnd80/10111816222D

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 10  8  2  0  0  0  0
 11  8  1  0  0  0  0
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 14  2  1  0  0  0  0
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 15  7  2  0  0  0  0
M  END
>  <Mol_ID> (1,892)
1892

>  <Formula> (1,892)
C17H13ClF3N5OS2

>  <MolWeight> (1,892)
459.8962296

>  <PCAT_CMPD_ID> (1,892)
WAY-384156

>  <CNC_ID> (1,892)
359400158

>  <transfer_container_id> (1,892)
PTN000000072

>  <COMPOUND_NUMBER> (1,892)
WAY-384156

>  <BAR_CODE_NO> (1,892)
2546255

>  <LOCATION_CODE> (1,892)
PTNCS

>  <AMOUNT_CURRENT> (1,892)
32.3

$$$$
WAY-384162
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  4  2  0  0  0  0
 13  8  2  0  0  0  0
 14  6  1  0  0  0  0
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 17  5  1  0  0  0  0
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 20  3  1  0  0  0  0
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 15  7  2  0  0  0  0
M  END
>  <Mol_ID> (1,893)
1893

>  <Formula> (1,893)
C14H15Cl2NO3

>  <MolWeight> (1,893)
316.1798

>  <PCAT_CMPD_ID> (1,893)
WAY-384162

>  <CNC_ID> (1,893)
359400164

>  <transfer_container_id> (1,893)
PTN000000072

>  <COMPOUND_NUMBER> (1,893)
WAY-384162

>  <BAR_CODE_NO> (1,893)
2546261

>  <LOCATION_CODE> (1,893)
PTNCS

>  <AMOUNT_CURRENT> (1,893)
32.8

$$$$
WAY-384188
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  3  1  0  0  0  0
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 21 17  2  0  0  0  0
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M  END
>  <Mol_ID> (1,894)
1894

>  <Formula> (1,894)
C17H12O4

>  <MolWeight> (1,894)
280.27478

>  <PCAT_CMPD_ID> (1,894)
WAY-384188

>  <CNC_ID> (1,894)
359400190

>  <transfer_container_id> (1,894)
PTN000000072

>  <COMPOUND_NUMBER> (1,894)
WAY-384188

>  <BAR_CODE_NO> (1,894)
2546857

>  <LOCATION_CODE> (1,894)
PTNCS

>  <AMOUNT_CURRENT> (1,894)
32.7

$$$$
WAY-384515
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 13  9  1  0  0  0  0
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 23 19  1  0  0  0  0
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M  END
>  <Mol_ID> (1,895)
1895

>  <Formula> (1,895)
C18H19N3O2S

>  <MolWeight> (1,895)
341.42736

>  <PCAT_CMPD_ID> (1,895)
WAY-384515

>  <CNC_ID> (1,895)
359400481

>  <transfer_container_id> (1,895)
PTN000000072

>  <COMPOUND_NUMBER> (1,895)
WAY-384515

>  <BAR_CODE_NO> (1,895)
2546660

>  <LOCATION_CODE> (1,895)
PTNCS

>  <AMOUNT_CURRENT> (1,895)
32.5

$$$$
WAY-384585
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  8  1  0  0  0  0
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  4  3  1  0  0  0  0
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  9  6  1  0  0  0  0
 10  5  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  2  0  0  0  0
 13  5  2  0  0  0  0
 14  1  1  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17  4  1  0  0  0  0
 18  4  1  0  0  0  0
 19 14  1  0  0  0  0
 20 15  1  0  0  0  0
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 22 18  1  0  0  0  0
 23 17  1  0  0  0  0
  9  2  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,896)
1896

>  <Formula> (1,896)
C16H21NO6

>  <MolWeight> (1,896)
323.34104

>  <PCAT_CMPD_ID> (1,896)
WAY-384585

>  <CNC_ID> (1,896)
359400550

>  <transfer_container_id> (1,896)
PTN000000072

>  <COMPOUND_NUMBER> (1,896)
WAY-384585

>  <BAR_CODE_NO> (1,896)
2546759

>  <LOCATION_CODE> (1,896)
PTNCS

>  <AMOUNT_CURRENT> (1,896)
32.1

$$$$
WAY-384637
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  9  1  0  0  0  0
 12  6  2  0  0  0  0
 13  4  2  0  0  0  0
 14  8  1  0  0  0  0
 15 12  1  0  0  0  0
 16  1  2  0  0  0  0
 17  6  1  0  0  0  0
 18 12  1  0  0  0  0
 19 10  2  0  0  0  0
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 23 20  2  0  0  0  0
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  7  3  1  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,897)
1897

>  <Formula> (1,897)
C17H14ClN3O2

>  <MolWeight> (1,897)
327.76496

>  <PCAT_CMPD_ID> (1,897)
WAY-384637

>  <CNC_ID> (1,897)
359400600

>  <transfer_container_id> (1,897)
PTN000000072

>  <COMPOUND_NUMBER> (1,897)
WAY-384637

>  <BAR_CODE_NO> (1,897)
2546813

>  <LOCATION_CODE> (1,897)
PTNCS

>  <AMOUNT_CURRENT> (1,897)
32

$$$$
WAY-384684
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11  6  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
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 17  3  2  0  0  0  0
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 19  7  2  0  0  0  0
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 22  6  1  0  0  0  0
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 24  8  1  0  0  0  0
 25 10  1  0  0  0  0
 26  9  1  0  0  0  0
 27  9  1  0  0  0  0
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 29 24  2  0  0  0  0
 30 29  1  0  0  0  0
 18 28  2  0  0  0  0
 10  5  1  0  0  0  0
 30 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,898)
1898

>  <Formula> (1,898)
C20H18N2O7S

>  <MolWeight> (1,898)
430.43112

>  <PCAT_CMPD_ID> (1,898)
WAY-384684

>  <CNC_ID> (1,898)
359400647

>  <transfer_container_id> (1,898)
PTN000000072

>  <COMPOUND_NUMBER> (1,898)
WAY-384684

>  <BAR_CODE_NO> (1,898)
2546921

>  <LOCATION_CODE> (1,898)
PTNCS

>  <AMOUNT_CURRENT> (1,898)
32.6

$$$$
WAY-384692
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  7  1  0  0  0  0
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 15  9  1  0  0  0  0
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  2  3  2  0  0  0  0
 10  7  1  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,899)
1899

>  <Formula> (1,899)
C15H16N2O3S

>  <MolWeight> (1,899)
304.36414

>  <PCAT_CMPD_ID> (1,899)
WAY-384692

>  <CNC_ID> (1,899)
359400655

>  <transfer_container_id> (1,899)
PTN000000072

>  <COMPOUND_NUMBER> (1,899)
WAY-384692

>  <BAR_CODE_NO> (1,899)
2546915

>  <LOCATION_CODE> (1,899)
PTNCS

>  <AMOUNT_CURRENT> (1,899)
32.6

$$$$
WAY-384716
csChFnd80/10111816222D

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 21  5  1  0  0  0  0
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  3  4  1  0  0  0  0
 29 28  1  0  0  0  0
 10 11  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,900)
1900

>  <Formula> (1,900)
C21H21N5O2S

>  <MolWeight> (1,900)
407.48874

>  <PCAT_CMPD_ID> (1,900)
WAY-384716

>  <CNC_ID> (1,900)
359400679

>  <transfer_container_id> (1,900)
PTN000000072

>  <COMPOUND_NUMBER> (1,900)
WAY-384716

>  <BAR_CODE_NO> (1,900)
2546945

>  <LOCATION_CODE> (1,900)
PTNCS

>  <AMOUNT_CURRENT> (1,900)
32.3

$$$$
WAY-384728
csChFnd80/10111816222D

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 18 13  2  0  0  0  0
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  3  5  1  0  0  0  0
 17 18  1  0  0  0  0
 22 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,901)
1901

>  <Formula> (1,901)
C17H16N4O2S2

>  <MolWeight> (1,901)
372.46454

>  <PCAT_CMPD_ID> (1,901)
WAY-384728

>  <CNC_ID> (1,901)
359400691

>  <transfer_container_id> (1,901)
PTN000000072

>  <COMPOUND_NUMBER> (1,901)
WAY-384728

>  <BAR_CODE_NO> (1,901)
2546533

>  <LOCATION_CODE> (1,901)
PTNCS

>  <AMOUNT_CURRENT> (1,901)
32.8

$$$$
WAY-384729
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
 11  2  1  0  0  0  0
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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (1,902)
1902

>  <Formula> (1,902)
C21H16N2O4S2

>  <MolWeight> (1,902)
424.49274

>  <PCAT_CMPD_ID> (1,902)
WAY-384729

>  <CNC_ID> (1,902)
359400692

>  <transfer_container_id> (1,902)
PTN000000072

>  <COMPOUND_NUMBER> (1,902)
WAY-384729

>  <BAR_CODE_NO> (1,902)
2546534

>  <LOCATION_CODE> (1,902)
PTNCS

>  <AMOUNT_CURRENT> (1,902)
32.7

$$$$
WAY-384820
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
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 15  9  2  0  0  0  0
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 18 15  1  0  0  0  0
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  6 11  2  0  0  0  0
 17 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,903)
1903

>  <Formula> (1,903)
C14H13N3S

>  <MolWeight> (1,903)
255.33812

>  <PCAT_CMPD_ID> (1,903)
WAY-384820

>  <CNC_ID> (1,903)
359400783

>  <transfer_container_id> (1,903)
PTN000000072

>  <COMPOUND_NUMBER> (1,903)
WAY-384820

>  <BAR_CODE_NO> (1,903)
2547254

>  <LOCATION_CODE> (1,903)
PTNCS

>  <AMOUNT_CURRENT> (1,903)
32.4

$$$$
WAY-385280
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  8  9  2  0  0  0  0
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M  END
>  <Mol_ID> (1,904)
1904

>  <Formula> (1,904)
C18H23N3O2S2

>  <MolWeight> (1,904)
377.52412

>  <PCAT_CMPD_ID> (1,904)
WAY-385280

>  <CNC_ID> (1,904)
359401195

>  <transfer_container_id> (1,904)
PTN000000072

>  <COMPOUND_NUMBER> (1,904)
WAY-385280

>  <BAR_CODE_NO> (1,904)
2547405

>  <LOCATION_CODE> (1,904)
PTNCS

>  <AMOUNT_CURRENT> (1,904)
32.6

$$$$
WAY-385351
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,905)
1905

>  <Formula> (1,905)
C15H11F2N3S

>  <MolWeight> (1,905)
303.3297464

>  <PCAT_CMPD_ID> (1,905)
WAY-385351

>  <CNC_ID> (1,905)
359401265

>  <transfer_container_id> (1,905)
PTN000000072

>  <COMPOUND_NUMBER> (1,905)
WAY-385351

>  <BAR_CODE_NO> (1,905)
2547450

>  <LOCATION_CODE> (1,905)
PTNCS

>  <AMOUNT_CURRENT> (1,905)
32.2

$$$$
WAY-385352
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,906)
1906

>  <Formula> (1,906)
C21H20ClN3O5S2

>  <MolWeight> (1,906)
493.9836

>  <PCAT_CMPD_ID> (1,906)
WAY-385352

>  <CNC_ID> (1,906)
359401266

>  <transfer_container_id> (1,906)
PTN000000072

>  <COMPOUND_NUMBER> (1,906)
WAY-385352

>  <BAR_CODE_NO> (1,906)
2547492

>  <LOCATION_CODE> (1,906)
PTNCS

>  <AMOUNT_CURRENT> (1,906)
32.3

$$$$
WAY-385394
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,907)
1907

>  <Formula> (1,907)
C19H25ClN2O3

>  <MolWeight> (1,907)
364.8664

>  <PCAT_CMPD_ID> (1,907)
WAY-385394

>  <CNC_ID> (1,907)
359401273

>  <transfer_container_id> (1,907)
PTN000000072

>  <COMPOUND_NUMBER> (1,907)
WAY-385394

>  <BAR_CODE_NO> (1,907)
2547504

>  <LOCATION_CODE> (1,907)
PTNCS

>  <AMOUNT_CURRENT> (1,907)
32.3

$$$$
WAY-385397
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  1  2  0  0  0  0
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 14  2  1  0  0  0  0
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M  END
>  <Mol_ID> (1,908)
1908

>  <Formula> (1,908)
C14H13ClN2O4

>  <MolWeight> (1,908)
308.71702

>  <PCAT_CMPD_ID> (1,908)
WAY-385397

>  <CNC_ID> (1,908)
359401276

>  <transfer_container_id> (1,908)
PTN000000072

>  <COMPOUND_NUMBER> (1,908)
WAY-385397

>  <BAR_CODE_NO> (1,908)
2547507

>  <LOCATION_CODE> (1,908)
PTNCS

>  <AMOUNT_CURRENT> (1,908)
32.5

$$$$
WAY-385424
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,909)
1909

>  <Formula> (1,909)
C12H20N4OS2

>  <MolWeight> (1,909)
300.4434

>  <PCAT_CMPD_ID> (1,909)
WAY-385424

>  <CNC_ID> (1,909)
359401303

>  <transfer_container_id> (1,909)
PTN000000072

>  <COMPOUND_NUMBER> (1,909)
WAY-385424

>  <BAR_CODE_NO> (1,909)
2547535

>  <LOCATION_CODE> (1,909)
PTNCS

>  <AMOUNT_CURRENT> (1,909)
32.4

$$$$
WAY-385535
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 10 15  3  0  0  0  0
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 19 20  1  0  0  0  0
 22 23  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,910)
1910

>  <Formula> (1,910)
C19H13N5O2

>  <MolWeight> (1,910)
343.33882

>  <PCAT_CMPD_ID> (1,910)
WAY-385535

>  <CNC_ID> (1,910)
359401365

>  <transfer_container_id> (1,910)
PTN000000072

>  <COMPOUND_NUMBER> (1,910)
WAY-385535

>  <BAR_CODE_NO> (1,910)
2547589

>  <LOCATION_CODE> (1,910)
PTNCS

>  <AMOUNT_CURRENT> (1,910)
33

$$$$
CL-356863
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
  5  7  1  0  0  0  0
  9 10  1  0  0  0  0
 16 17  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,911)
1911

>  <Formula> (1,911)
C18H16N2OS

>  <MolWeight> (1,911)
308.39744

>  <PCAT_CMPD_ID> (1,911)
CL-356863

>  <CNC_ID> (1,911)
359407673

>  <transfer_container_id> (1,911)
PTN000000073

>  <COMPOUND_NUMBER> (1,911)
CL-356863

>  <BAR_CODE_NO> (1,911)
3909082

>  <LOCATION_CODE> (1,911)
PTNCS

>  <AMOUNT_CURRENT> (1,911)
33.8

$$$$
CL-414355
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
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  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
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  6 14  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  3  0  0  0  0
 11 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  9 12  1  0  0  0  0
 13 19  1  0  0  0  0
 15 16  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,912)
1912

>  <Formula> (1,912)
C20H16N2O2S

>  <MolWeight> (1,912)
348.41824

>  <PCAT_CMPD_ID> (1,912)
CL-414355

>  <CNC_ID> (1,912)
359407704

>  <transfer_container_id> (1,912)
PTN000000073

>  <COMPOUND_NUMBER> (1,912)
CL-414355

>  <BAR_CODE_NO> (1,912)
3910894

>  <LOCATION_CODE> (1,912)
PTNCS

>  <AMOUNT_CURRENT> (1,912)
33.4

$$$$
GI-506782
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 13 19  2  0  0  0  0
 17 20  2  0  0  0  0
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 18 22  1  0  0  0  0
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 24 26  2  0  0  0  0
  6  9  1  0  0  0  0
 15 19  1  0  0  0  0
 22 23  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,913)
1913

>  <Formula> (1,913)
C20H16Cl2N2O2

>  <MolWeight> (1,913)
387.25924

>  <PCAT_CMPD_ID> (1,913)
GI-506782

>  <CNC_ID> (1,913)
359407755

>  <transfer_container_id> (1,913)
PTN000000073

>  <COMPOUND_NUMBER> (1,913)
GI-506782

>  <BAR_CODE_NO> (1,913)
3910029

>  <LOCATION_CODE> (1,913)
PTNCS

>  <AMOUNT_CURRENT> (1,913)
33.4

$$$$
WAY-218611
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
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  8  2  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  2  0  0  0  0
 14 12  2  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 17 12  1  0  0  0  0
 18 11  2  0  0  0  0
 19 11  1  0  0  0  0
 20 17  1  0  0  0  0
 21 20  1  0  0  0  0
 22 19  2  0  0  0  0
 23 18  1  0  0  0  0
 24 22  1  0  0  0  0
  4  8  2  0  0  0  0
  7  5  2  0  0  0  0
 24 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,914)
1914

>  <Formula> (1,914)
C18H18N2O4

>  <MolWeight> (1,914)
326.34652

>  <PCAT_CMPD_ID> (1,914)
WAY-218611

>  <CNC_ID> (1,914)
359407934

>  <transfer_container_id> (1,914)
PTN000000073

>  <COMPOUND_NUMBER> (1,914)
WAY-218611

>  <BAR_CODE_NO> (1,914)
3909855

>  <LOCATION_CODE> (1,914)
PTNCS

>  <AMOUNT_CURRENT> (1,914)
33.7

$$$$
WAY-226702
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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   -0.6074   -0.2165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7522    1.0111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5729    2.2352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7522   -1.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4694   -0.2510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  2  0  0  0  0
 11 14  2  0  0  0  0
  7  9  1  0  0  0  0
 13 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,915)
1915

>  <Formula> (1,915)
C10H9NO2S

>  <MolWeight> (1,915)
207.24896

>  <PCAT_CMPD_ID> (1,915)
WAY-226702

>  <CNC_ID> (1,915)
359407986

>  <transfer_container_id> (1,915)
PTN000000073

>  <COMPOUND_NUMBER> (1,915)
WAY-226702

>  <BAR_CODE_NO> (1,915)
3909810

>  <LOCATION_CODE> (1,915)
PTNCS

>  <AMOUNT_CURRENT> (1,915)
33.9

$$$$
WAY-229805
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.1030    0.3643    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0340    0.9057    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7936    0.8712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7936   -3.9771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
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 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
  9 12  1  0  0  0  0
 14 16  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,916)
1916

>  <Formula> (1,916)
C15H15FN2O4S

>  <MolWeight> (1,916)
338.3540032

>  <PCAT_CMPD_ID> (1,916)
WAY-229805

>  <CNC_ID> (1,916)
359408017

>  <transfer_container_id> (1,916)
PTN000000073

>  <COMPOUND_NUMBER> (1,916)
WAY-229805

>  <BAR_CODE_NO> (1,916)
3910810

>  <LOCATION_CODE> (1,916)
PTNCS

>  <AMOUNT_CURRENT> (1,916)
33.5

$$$$
WAY-230712
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    1.9000   -0.7515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9000   -1.9032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.3138    3.2623    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 11  1  0  0  0  0
  8  9  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,917)
1917

>  <Formula> (1,917)
C17H13FO3

>  <MolWeight> (1,917)
284.2817232

>  <PCAT_CMPD_ID> (1,917)
WAY-230712

>  <CNC_ID> (1,917)
359408022

>  <transfer_container_id> (1,917)
PTN000000073

>  <COMPOUND_NUMBER> (1,917)
WAY-230712

>  <BAR_CODE_NO> (1,917)
3910813

>  <LOCATION_CODE> (1,917)
PTNCS

>  <AMOUNT_CURRENT> (1,917)
33.4

$$$$
WAY-232261
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    3.6327    2.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4166    1.4033    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6327    3.5236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  3  1  0  0  0  0
  6 11  2  0  0  0  0
  7  6  1  0  0  0  0
  8  1  2  0  0  0  0
  9  2  1  0  0  0  0
 10  2  2  0  0  0  0
 11  8  1  0  0  0  0
 12 18  1  0  0  0  0
 13 20  1  0  0  0  0
 14  5  1  0  0  0  0
 15  5  1  0  0  0  0
 16  7  1  0  0  0  0
 17  7  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20 15  1  0  0  0  0
 21 14  1  0  0  0  0
  4  6  1  0  0  0  0
 13 21  1  0  0  0  0
 12 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,918)
1918

>  <Formula> (1,918)
C14H20N4O3

>  <MolWeight> (1,918)
292.3336

>  <PCAT_CMPD_ID> (1,918)
WAY-232261

>  <CNC_ID> (1,918)
359408033

>  <transfer_container_id> (1,918)
PTN000000073

>  <COMPOUND_NUMBER> (1,918)
WAY-232261

>  <BAR_CODE_NO> (1,918)
3910615

>  <LOCATION_CODE> (1,918)
PTNCS

>  <AMOUNT_CURRENT> (1,918)
33.7

$$$$
WAY-232400
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    4.8810    5.2693    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  9  2  0  0  0  0
 12  7  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  2  0  0  0  0
 15  8  2  0  0  0  0
 16 12  2  0  0  0  0
 17  9  1  0  0  0  0
 18  8  1  0  0  0  0
 19 20  1  0  0  0  0
 20 17  2  0  0  0  0
 21 12  1  0  0  0  0
  2  4  1  0  0  0  0
 19 10  2  0  0  0  0
M  END
>  <Mol_ID> (1,919)
1919

>  <Formula> (1,919)
C12H12N4O4S

>  <MolWeight> (1,919)
308.31308

>  <PCAT_CMPD_ID> (1,919)
WAY-232400

>  <CNC_ID> (1,919)
359408035

>  <transfer_container_id> (1,919)
PTN000000073

>  <COMPOUND_NUMBER> (1,919)
WAY-232400

>  <BAR_CODE_NO> (1,919)
3910751

>  <LOCATION_CODE> (1,919)
PTNCS

>  <AMOUNT_CURRENT> (1,919)
33.1

$$$$
WAY-232900
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.6582    0.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3789    0.1483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2168   -0.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
  5  7  1  0  0  0  0
  9 13  2  0  0  0  0
 11 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,920)
1920

>  <Formula> (1,920)
C12H10N4O2S

>  <MolWeight> (1,920)
274.2984

>  <PCAT_CMPD_ID> (1,920)
WAY-232900

>  <CNC_ID> (1,920)
359408038

>  <transfer_container_id> (1,920)
PTN000000073

>  <COMPOUND_NUMBER> (1,920)
WAY-232900

>  <BAR_CODE_NO> (1,920)
3910742

>  <LOCATION_CODE> (1,920)
PTNCS

>  <AMOUNT_CURRENT> (1,920)
33.2

$$$$
WAY-234659
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 10  7  1  0  0  0  0
 11 12  1  0  0  0  0
 12  9  1  0  0  0  0
 13  4  1  0  0  0  0
 14  5  1  0  0  0  0
 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17 13  2  0  0  0  0
 18 14  2  0  0  0  0
 19 16  2  0  0  0  0
 20 19  1  0  0  0  0
  5  4  2  0  0  0  0
 18 17  1  0  0  0  0
 20 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,921)
1921

>  <Formula> (1,921)
C15H14ClN3O

>  <MolWeight> (1,921)
287.74416

>  <PCAT_CMPD_ID> (1,921)
WAY-234659

>  <CNC_ID> (1,921)
359408052

>  <transfer_container_id> (1,921)
PTN000000073

>  <COMPOUND_NUMBER> (1,921)
WAY-234659

>  <BAR_CODE_NO> (1,921)
3910908

>  <LOCATION_CODE> (1,921)
PTNCS

>  <AMOUNT_CURRENT> (1,921)
33.1

$$$$
WAY-238087
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  8 16  2  0  0  0  0
 10 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
 19 23  2  0  0  0  0
 20 24  2  0  0  0  0
 22 25  2  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
  7 12  2  0  0  0  0
  9 16  1  0  0  0  0
 20 22  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (1,922)
1922

>  <Formula> (1,922)
C22H20N2O3

>  <MolWeight> (1,922)
360.4058

>  <PCAT_CMPD_ID> (1,922)
WAY-238087

>  <CNC_ID> (1,922)
359408081

>  <transfer_container_id> (1,922)
PTN000000073

>  <COMPOUND_NUMBER> (1,922)
WAY-238087

>  <BAR_CODE_NO> (1,922)
3910928

>  <LOCATION_CODE> (1,922)
PTNCS

>  <AMOUNT_CURRENT> (1,922)
33.5

$$$$
WAY-238682
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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  1  4  1  0  0  0  0
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  4  9  2  0  0  0  0
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 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 16 18  1  0  0  0  0
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 18 20  1  0  0  0  0
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 23 25  2  0  0  0  0
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 26 27  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
 19 20  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (1,923)
1923

>  <Formula> (1,923)
C21H21N3O3

>  <MolWeight> (1,923)
363.40974

>  <PCAT_CMPD_ID> (1,923)
WAY-238682

>  <CNC_ID> (1,923)
359408088

>  <transfer_container_id> (1,923)
PTN000000073

>  <COMPOUND_NUMBER> (1,923)
WAY-238682

>  <BAR_CODE_NO> (1,923)
3909163

>  <LOCATION_CODE> (1,923)
PTNCS

>  <AMOUNT_CURRENT> (1,923)
33.5

$$$$
WAY-239967
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
    2.4159    6.9733    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  4  2  0  0  0  0
  9 10  2  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14 15  1  0  0  0  0
 15  7  2  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
  7  3  1  0  0  0  0
 14 12  2  0  0  0  0
  6  9  1  0  0  0  0
M  END
>  <Mol_ID> (1,924)
1924

>  <Formula> (1,924)
C14H14N2O

>  <MolWeight> (1,924)
226.27376

>  <PCAT_CMPD_ID> (1,924)
WAY-239967

>  <CNC_ID> (1,924)
359408098

>  <transfer_container_id> (1,924)
PTN000000073

>  <COMPOUND_NUMBER> (1,924)
WAY-239967

>  <BAR_CODE_NO> (1,924)
3910544

>  <LOCATION_CODE> (1,924)
PTNCS

>  <AMOUNT_CURRENT> (1,924)
33.9

$$$$
WAY-305676
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.7034   -0.4690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 14  1  0  0  0  0
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 16 18  1  0  0  0  0
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 23 25  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,925)
1925

>  <Formula> (1,925)
C19H20N2O4

>  <MolWeight> (1,925)
340.3731

>  <PCAT_CMPD_ID> (1,925)
WAY-305676

>  <CNC_ID> (1,925)
359408177

>  <transfer_container_id> (1,925)
PTN000000073

>  <COMPOUND_NUMBER> (1,925)
WAY-305676

>  <BAR_CODE_NO> (1,925)
3908996

>  <LOCATION_CODE> (1,925)
PTNCS

>  <AMOUNT_CURRENT> (1,925)
33.7

$$$$
WAY-305723
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,926)
1926

>  <Formula> (1,926)
C17H23N3O2S2

>  <MolWeight> (1,926)
365.51342

>  <PCAT_CMPD_ID> (1,926)
WAY-305723

>  <CNC_ID> (1,926)
359408224

>  <transfer_container_id> (1,926)
PTN000000073

>  <COMPOUND_NUMBER> (1,926)
WAY-305723

>  <BAR_CODE_NO> (1,926)
3909049

>  <LOCATION_CODE> (1,926)
PTNCS

>  <AMOUNT_CURRENT> (1,926)
33.3

$$$$
WAY-305731
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  6 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 12 14  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,927)
1927

>  <Formula> (1,927)
C10H14N2O2

>  <MolWeight> (1,927)
194.23036

>  <PCAT_CMPD_ID> (1,927)
WAY-305731

>  <CNC_ID> (1,927)
359408232

>  <transfer_container_id> (1,927)
PTN000000073

>  <COMPOUND_NUMBER> (1,927)
WAY-305731

>  <BAR_CODE_NO> (1,927)
3909059

>  <LOCATION_CODE> (1,927)
PTNCS

>  <AMOUNT_CURRENT> (1,927)
33.7

$$$$
WAY-305733
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10 15  2  0  0  0  0
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 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 16 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
  5  7  1  0  0  0  0
 15 18  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,928)
1928

>  <Formula> (1,928)
C19H15ClN2OS

>  <MolWeight> (1,928)
354.8532

>  <PCAT_CMPD_ID> (1,928)
WAY-305733

>  <CNC_ID> (1,928)
359408234

>  <transfer_container_id> (1,928)
PTN000000073

>  <COMPOUND_NUMBER> (1,928)
WAY-305733

>  <BAR_CODE_NO> (1,928)
3909062

>  <LOCATION_CODE> (1,928)
PTNCS

>  <AMOUNT_CURRENT> (1,928)
33.2

$$$$
WAY-305774
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.6241   -0.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
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 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
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 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
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 21 23  2  0  0  0  0
  8 11  1  0  0  0  0
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 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,929)
1929

>  <Formula> (1,929)
C16H15N3O4

>  <MolWeight> (1,929)
313.308

>  <PCAT_CMPD_ID> (1,929)
WAY-305774

>  <CNC_ID> (1,929)
359408275

>  <transfer_container_id> (1,929)
PTN000000073

>  <COMPOUND_NUMBER> (1,929)
WAY-305774

>  <BAR_CODE_NO> (1,929)
3909107

>  <LOCATION_CODE> (1,929)
PTNCS

>  <AMOUNT_CURRENT> (1,929)
33.2

$$$$
WAY-305788
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 11 15  1  0  0  0  0
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 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 13  1  0  0  0  0
 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,930)
1930

>  <Formula> (1,930)
C15H22N2O4

>  <MolWeight> (1,930)
294.34618

>  <PCAT_CMPD_ID> (1,930)
WAY-305788

>  <CNC_ID> (1,930)
359408289

>  <transfer_container_id> (1,930)
PTN000000073

>  <COMPOUND_NUMBER> (1,930)
WAY-305788

>  <BAR_CODE_NO> (1,930)
3909122

>  <LOCATION_CODE> (1,930)
PTNCS

>  <AMOUNT_CURRENT> (1,930)
33.5

$$$$
WAY-305967
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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   -0.5897    2.2379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
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  5  9  1  0  0  0  0
  7 10  2  0  0  0  0
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 10 14  1  0  0  0  0
 11 15  2  0  0  0  0
 13 16  1  0  0  0  0
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 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
  5  8  1  0  0  0  0
 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,931)
1931

>  <Formula> (1,931)
C13H12N2O3S2

>  <MolWeight> (1,931)
308.37598

>  <PCAT_CMPD_ID> (1,931)
WAY-305967

>  <CNC_ID> (1,931)
359408468

>  <transfer_container_id> (1,931)
PTN000000073

>  <COMPOUND_NUMBER> (1,931)
WAY-305967

>  <BAR_CODE_NO> (1,931)
3909331

>  <LOCATION_CODE> (1,931)
PTNCS

>  <AMOUNT_CURRENT> (1,931)
33

$$$$
WAY-306152
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  2  0  0  0  0
  7 14  1  0  0  0  0
  8 15  2  0  0  0  0
  9 16  1  0  0  0  0
 10 17  3  0  0  0  0
 12 18  2  0  0  0  0
 14 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
  9 11  1  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,932)
1932

>  <Formula> (1,932)
C17H14N2O3

>  <MolWeight> (1,932)
294.30466

>  <PCAT_CMPD_ID> (1,932)
WAY-306152

>  <CNC_ID> (1,932)
359408653

>  <transfer_container_id> (1,932)
PTN000000073

>  <COMPOUND_NUMBER> (1,932)
WAY-306152

>  <BAR_CODE_NO> (1,932)
3909588

>  <LOCATION_CODE> (1,932)
PTNCS

>  <AMOUNT_CURRENT> (1,932)
33.2

$$$$
WAY-306173
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
    2.9448    1.2586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  2  0  0  0  0
 10 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 20 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  6  9  1  0  0  0  0
 14 16  1  0  0  0  0
 21 22  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,933)
1933

>  <Formula> (1,933)
C19H16N2O4

>  <MolWeight> (1,933)
336.34134

>  <PCAT_CMPD_ID> (1,933)
WAY-306173

>  <CNC_ID> (1,933)
359408674

>  <transfer_container_id> (1,933)
PTN000000073

>  <COMPOUND_NUMBER> (1,933)
WAY-306173

>  <BAR_CODE_NO> (1,933)
3909611

>  <LOCATION_CODE> (1,933)
PTNCS

>  <AMOUNT_CURRENT> (1,933)
33.7

$$$$
WAY-306266
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    3.6268    4.2202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  3  1  0  0  0  0
 12 11  3  0  0  0  0
 13  5  1  0  0  0  0
 14  4  2  0  0  0  0
 15  6  1  0  0  0  0
 16 13  2  0  0  0  0
 17 13  1  0  0  0  0
 18 19  1  0  0  0  0
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 20 16  1  0  0  0  0
 21  8  1  0  0  0  0
 22 18  1  0  0  0  0
 23 10  1  0  0  0  0
 24 22  1  0  0  0  0
 25 21  2  0  0  0  0
 26 23  2  0  0  0  0
  7  6  1  0  0  0  0
 10  8  2  0  0  0  0
 20 18  2  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,934)
1934

>  <Formula> (1,934)
C20H14N2O4

>  <MolWeight> (1,934)
346.33616

>  <PCAT_CMPD_ID> (1,934)
WAY-306266

>  <CNC_ID> (1,934)
359408766

>  <transfer_container_id> (1,934)
PTN000000073

>  <COMPOUND_NUMBER> (1,934)
WAY-306266

>  <BAR_CODE_NO> (1,934)
3909753

>  <LOCATION_CODE> (1,934)
PTNCS

>  <AMOUNT_CURRENT> (1,934)
33.3

$$$$
WAY-306309
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
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  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
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 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
  5  7  1  0  0  0  0
  9 13  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (1,935)
1935

>  <Formula> (1,935)
C14H16N2O3S

>  <MolWeight> (1,935)
292.35344

>  <PCAT_CMPD_ID> (1,935)
WAY-306309

>  <CNC_ID> (1,935)
359408809

>  <transfer_container_id> (1,935)
PTN000000073

>  <COMPOUND_NUMBER> (1,935)
WAY-306309

>  <BAR_CODE_NO> (1,935)
3909805

>  <LOCATION_CODE> (1,935)
PTNCS

>  <AMOUNT_CURRENT> (1,935)
33

$$$$
WAY-306654
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,936)
1936

>  <Formula> (1,936)
C16H16ClN5O3

>  <MolWeight> (1,936)
361.78294

>  <PCAT_CMPD_ID> (1,936)
WAY-306654

>  <CNC_ID> (1,936)
359409152

>  <transfer_container_id> (1,936)
PTN000000073

>  <COMPOUND_NUMBER> (1,936)
WAY-306654

>  <BAR_CODE_NO> (1,936)
3910238

>  <LOCATION_CODE> (1,936)
PTNCS

>  <AMOUNT_CURRENT> (1,936)
33.5

$$$$
WAY-306655
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,937)
1937

>  <Formula> (1,937)
C15H20FNO

>  <MolWeight> (1,937)
249.3238032

>  <PCAT_CMPD_ID> (1,937)
WAY-306655

>  <CNC_ID> (1,937)
359409153

>  <transfer_container_id> (1,937)
PTN000000073

>  <COMPOUND_NUMBER> (1,937)
WAY-306655

>  <BAR_CODE_NO> (1,937)
3910239

>  <LOCATION_CODE> (1,937)
PTNCS

>  <AMOUNT_CURRENT> (1,937)
33.6

$$$$
WAY-306668
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,938)
1938

>  <Formula> (1,938)
C16H14N2O3

>  <MolWeight> (1,938)
282.29396

>  <PCAT_CMPD_ID> (1,938)
WAY-306668

>  <CNC_ID> (1,938)
359409166

>  <transfer_container_id> (1,938)
PTN000000073

>  <COMPOUND_NUMBER> (1,938)
WAY-306668

>  <BAR_CODE_NO> (1,938)
3910257

>  <LOCATION_CODE> (1,938)
PTNCS

>  <AMOUNT_CURRENT> (1,938)
33.1

$$$$
WAY-306691
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,939)
1939

>  <Formula> (1,939)
C13H11N3S2

>  <MolWeight> (1,939)
273.37654

>  <PCAT_CMPD_ID> (1,939)
WAY-306691

>  <CNC_ID> (1,939)
359409189

>  <transfer_container_id> (1,939)
PTN000000073

>  <COMPOUND_NUMBER> (1,939)
WAY-306691

>  <BAR_CODE_NO> (1,939)
3910287

>  <LOCATION_CODE> (1,939)
PTNCS

>  <AMOUNT_CURRENT> (1,939)
33.8

$$$$
WAY-306730
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (1,940)
1940

>  <Formula> (1,940)
C24H27N3O3S

>  <MolWeight> (1,940)
437.55448

>  <PCAT_CMPD_ID> (1,940)
WAY-306730

>  <CNC_ID> (1,940)
359409228

>  <transfer_container_id> (1,940)
PTN000000073

>  <COMPOUND_NUMBER> (1,940)
WAY-306730

>  <BAR_CODE_NO> (1,940)
3910338

>  <LOCATION_CODE> (1,940)
PTNCS

>  <AMOUNT_CURRENT> (1,940)
33

$$$$
WAY-306744
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
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 26 28  1  0  0  0  0
 12 17  2  0  0  0  0
 19 22  1  0  0  0  0
 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,941)
1941

>  <Formula> (1,941)
C20H19N3O4S

>  <MolWeight> (1,941)
397.44756

>  <PCAT_CMPD_ID> (1,941)
WAY-306744

>  <CNC_ID> (1,941)
359409242

>  <transfer_container_id> (1,941)
PTN000000073

>  <COMPOUND_NUMBER> (1,941)
WAY-306744

>  <BAR_CODE_NO> (1,941)
3910354

>  <LOCATION_CODE> (1,941)
PTNCS

>  <AMOUNT_CURRENT> (1,941)
33.8

$$$$
WAY-307378
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    2.2514   -1.0138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
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  5  8  1  0  0  0  0
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  5 10  2  0  0  0  0
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 14 16  2  0  0  0  0
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 27 28  1  0  0  0  0
 28 29  3  0  0  0  0
  7 11  1  0  0  0  0
 17 18  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (1,942)
1942

>  <Formula> (1,942)
C20H17N5O3S

>  <MolWeight> (1,942)
407.44568

>  <PCAT_CMPD_ID> (1,942)
WAY-307378

>  <CNC_ID> (1,942)
359409877

>  <transfer_container_id> (1,942)
PTN000000073

>  <COMPOUND_NUMBER> (1,942)
WAY-307378

>  <BAR_CODE_NO> (1,942)
3911147

>  <LOCATION_CODE> (1,942)
PTNCS

>  <AMOUNT_CURRENT> (1,942)
33.4

$$$$
WAY-323393
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
   -1.6375   -0.0750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4  1  1  0  0  0  0
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 10 18  1  0  0  0  0
 11  6  1  0  0  0  0
 12  5  1  0  0  0  0
 13  8  1  0  0  0  0
 14  9  2  0  0  0  0
 15  2  2  0  0  0  0
 16  4  2  0  0  0  0
 17 19  1  0  0  0  0
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 21 14  1  0  0  0  0
 22  9  1  0  0  0  0
 23 21  1  0  0  0  0
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 25 12  1  0  0  0  0
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 27 24  1  0  0  0  0
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 29 28  1  0  0  0  0
 30 25  2  0  0  0  0
 31 26  2  0  0  0  0
  7  6  1  0  0  0  0
 27 21  2  0  0  0  0
 10 17  1  0  0  0  0
 13 12  2  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,943)
1943

>  <Formula> (1,943)
C23H24N4O3S

>  <MolWeight> (1,943)
436.52666

>  <PCAT_CMPD_ID> (1,943)
WAY-323393

>  <CNC_ID> (1,943)
359410144

>  <transfer_container_id> (1,943)
PTN000000074

>  <COMPOUND_NUMBER> (1,943)
WAY-323393

>  <BAR_CODE_NO> (1,943)
2551028

>  <LOCATION_CODE> (1,943)
PTNCS

>  <AMOUNT_CURRENT> (1,943)
32.6

$$$$
WAY-323591
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    5.0167   -4.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  4  2  0  0  0  0
 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  6  1  0  0  0  0
 15  2  2  0  0  0  0
 16  5  1  0  0  0  0
 17  6  2  0  0  0  0
 18 16  1  0  0  0  0
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 20 15  1  0  0  0  0
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 25 22  1  0  0  0  0
  8 13  1  0  0  0  0
 21 17  1  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,944)
1944

>  <Formula> (1,944)
C20H27ClN2O2

>  <MolWeight> (1,944)
362.89358

>  <PCAT_CMPD_ID> (1,944)
WAY-323591

>  <CNC_ID> (1,944)
359410339

>  <transfer_container_id> (1,944)
PTN000000076

>  <COMPOUND_NUMBER> (1,944)
WAY-323591

>  <BAR_CODE_NO> (1,944)
2569057

>  <LOCATION_CODE> (1,944)
PTNCS

>  <AMOUNT_CURRENT> (1,944)
32.2

$$$$
WAY-324197
csChFnd80/10111816222D

 24 28  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  9  2  0  0  0  0
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 13  5  1  0  0  0  0
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 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
  8 10  1  0  0  0  0
  3  5  1  0  0  0  0
  8 14  1  0  0  0  0
 18 16  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,945)
1945

>  <Formula> (1,945)
C21H22N2O

>  <MolWeight> (1,945)
318.41218

>  <PCAT_CMPD_ID> (1,945)
WAY-324197

>  <CNC_ID> (1,945)
359410934

>  <transfer_container_id> (1,945)
PTN000000073

>  <COMPOUND_NUMBER> (1,945)
WAY-324197

>  <BAR_CODE_NO> (1,945)
2549711

>  <LOCATION_CODE> (1,945)
PTNCS

>  <AMOUNT_CURRENT> (1,945)
32.4

$$$$
WAY-340244
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -1.8242   -0.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1621   -1.2100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1793    1.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1345   -0.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9034   -1.1996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
  7 10  2  0  0  0  0
  9 11  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,946)
1946

>  <Formula> (1,946)
C15H11NO3

>  <MolWeight> (1,946)
253.25274

>  <PCAT_CMPD_ID> (1,946)
WAY-340244

>  <CNC_ID> (1,946)
359412260

>  <transfer_container_id> (1,946)
PTN000000073

>  <COMPOUND_NUMBER> (1,946)
WAY-340244

>  <BAR_CODE_NO> (1,946)
2550205

>  <LOCATION_CODE> (1,946)
PTNCS

>  <AMOUNT_CURRENT> (1,946)
30.6

$$$$
WAY-340245
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    8.3348    2.6120    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1734    1.4758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0030    2.1815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5667    1.4758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3443    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7639    3.9592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5671    2.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2524    6.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8206    4.9752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  2  0  0  0  0
  7 15  1  0  0  0  0
  8  2  2  0  0  0  0
  9 17  1  0  0  0  0
 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
 12  6  1  0  0  0  0
 13  9  1  0  0  0  0
 14 10  1  0  0  0  0
 15 12  2  0  0  0  0
 16  1  1  0  0  0  0
 17 18  2  0  0  0  0
 18 12  1  0  0  0  0
 19 20  1  0  0  0  0
 20 16  1  0  0  0  0
  5  4  1  0  0  0  0
  9  7  2  0  0  0  0
 13 14  1  0  0  0  0
M  END
>  <Mol_ID> (1,947)
1947

>  <Formula> (1,947)
C13H12N2O4S

>  <MolWeight> (1,947)
292.31038

>  <PCAT_CMPD_ID> (1,947)
WAY-340245

>  <CNC_ID> (1,947)
359412261

>  <transfer_container_id> (1,947)
PTN000000073

>  <COMPOUND_NUMBER> (1,947)
WAY-340245

>  <BAR_CODE_NO> (1,947)
2550206

>  <LOCATION_CODE> (1,947)
PTNCS

>  <AMOUNT_CURRENT> (1,947)
32.4

$$$$
WAY-340319
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    1.9042    1.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1792   -0.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4542   -3.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0917    3.3333    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6792   -0.9167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7417   -5.1417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6417   -0.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0250   -7.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5958    1.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6500  -11.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -13.6375    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.5292   -7.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8167   -9.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8292   -9.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1042  -11.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8792    5.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6208    5.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 10  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  2  0  0  0  0
  8 12  1  0  0  0  0
  9  3  2  0  0  0  0
 10  5  1  0  0  0  0
 11  6  1  0  0  0  0
 12  1  2  0  0  0  0
 13 18  2  0  0  0  0
 14 13  1  0  0  0  0
 15 11  1  0  0  0  0
 16 11  2  0  0  0  0
 17 15  2  0  0  0  0
 18 16  1  0  0  0  0
 19  4  2  0  0  0  0
 20  8  2  0  0  0  0
 19 20  1  0  0  0  0
 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,948)
1948

>  <Formula> (1,948)
C13H10ClN3O3

>  <MolWeight> (1,948)
291.6898

>  <PCAT_CMPD_ID> (1,948)
WAY-340319

>  <CNC_ID> (1,948)
359412326

>  <transfer_container_id> (1,948)
PTN000000073

>  <COMPOUND_NUMBER> (1,948)
WAY-340319

>  <BAR_CODE_NO> (1,948)
2550227

>  <LOCATION_CODE> (1,948)
PTNCS

>  <AMOUNT_CURRENT> (1,948)
32.3

$$$$
WAY-340329
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    0.6041    0.0704    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9666   -0.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4792    0.7329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8292    1.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6042    1.9996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9167    0.7579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9667    1.3954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6209    0.7704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7  1  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10  2  1  0  0  0  0
 11 10  2  0  0  0  0
 12 16  1  0  0  0  0
 13  4  1  0  0  0  0
 14  8  1  0  0  0  0
 15  7  1  0  0  0  0
 16 15  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
 19 20  1  0  0  0  0
 20 18  2  0  0  0  0
  8  4  2  0  0  0  0
 19 17  2  0  0  0  0
M  END
>  <Mol_ID> (1,949)
1949

>  <Formula> (1,949)
C13H12F2N2O2S

>  <MolWeight> (1,949)
298.3083864

>  <PCAT_CMPD_ID> (1,949)
WAY-340329

>  <CNC_ID> (1,949)
359412336

>  <transfer_container_id> (1,949)
PTN000000073

>  <COMPOUND_NUMBER> (1,949)
WAY-340329

>  <BAR_CODE_NO> (1,949)
2550237

>  <LOCATION_CODE> (1,949)
PTNCS

>  <AMOUNT_CURRENT> (1,949)
32.4

$$$$
WAY-384623
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    5.0042   -3.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3917   -3.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  2  1  0  0  0  0
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  5  1  2  0  0  0  0
  6  9  2  0  0  0  0
  7  3  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10  7  1  0  0  0  0
 11 13  1  0  0  0  0
 12  3  2  0  0  0  0
 13 21  1  0  0  0  0
 14  5  1  0  0  0  0
 15  4  1  0  0  0  0
 16  2  2  0  0  0  0
 17  9  1  0  0  0  0
 18  8  2  0  0  0  0
 19  8  1  0  0  0  0
 20 13  2  0  0  0  0
 21 17  1  0  0  0  0
 22  4  1  0  0  0  0
 23  7  2  0  0  0  0
 24 10  2  0  0  0  0
 25 26  1  0  0  0  0
 26 19  2  0  0  0  0
 27 18  1  0  0  0  0
 28 18  1  0  0  0  0
 29 19  1  0  0  0  0
 30 23  1  0  0  0  0
 31 30  2  0  0  0  0
 14 15  2  0  0  0  0
  6 10  1  0  0  0  0
 24 31  1  0  0  0  0
 27 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,950)
1950

>  <Formula> (1,950)
C24H22N4O2S

>  <MolWeight> (1,950)
430.52208

>  <PCAT_CMPD_ID> (1,950)
WAY-384623

>  <CNC_ID> (1,950)
359412438

>  <transfer_container_id> (1,950)
PTN000000073

>  <COMPOUND_NUMBER> (1,950)
WAY-384623

>  <BAR_CODE_NO> (1,950)
2550058

>  <LOCATION_CODE> (1,950)
PTNCS

>  <AMOUNT_CURRENT> (1,950)
32.5

$$$$
WAY-385696
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    4.7000   -3.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 17 12  1  0  0  0  0
 18 16  1  0  0  0  0
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  7  5  2  0  0  0  0
 24 27  1  0  0  0  0
 26 28  2  0  0  0  0
 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,951)
1951

>  <Formula> (1,951)
C21H22FN5O

>  <MolWeight> (1,951)
379.4306832

>  <PCAT_CMPD_ID> (1,951)
WAY-385696

>  <CNC_ID> (1,951)
359412659

>  <transfer_container_id> (1,951)
PTN000000073

>  <COMPOUND_NUMBER> (1,951)
WAY-385696

>  <BAR_CODE_NO> (1,951)
2547911

>  <LOCATION_CODE> (1,951)
PTNCS

>  <AMOUNT_CURRENT> (1,951)
32.6

$$$$
WAY-385719
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   10.2667   -6.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  8  1  0  0  0  0
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  7  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9  5  1  0  0  0  0
 10  3  1  0  0  0  0
 11  3  2  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14  2  1  0  0  0  0
 15  7  1  0  0  0  0
 16  9  2  0  0  0  0
 17 12  1  0  0  0  0
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  6  7  2  0  0  0  0
 27 22  1  0  0  0  0
 18 24  1  0  0  0  0
 28 25  2  0  0  0  0
M  END
>  <Mol_ID> (1,952)
1952

>  <Formula> (1,952)
C22H25N5O

>  <MolWeight> (1,952)
375.4668

>  <PCAT_CMPD_ID> (1,952)
WAY-385719

>  <CNC_ID> (1,952)
359412682

>  <transfer_container_id> (1,952)
PTN000000073

>  <COMPOUND_NUMBER> (1,952)
WAY-385719

>  <BAR_CODE_NO> (1,952)
2548201

>  <LOCATION_CODE> (1,952)
PTNCS

>  <AMOUNT_CURRENT> (1,952)
32.9

$$$$
WAY-385751
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  3  2  0  0  0  0
 13 10  1  0  0  0  0
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 15  8  2  0  0  0  0
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 18 14  1  0  0  0  0
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 20  6  1  0  0  0  0
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 30 14  2  0  0  0  0
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  4  5  1  0  0  0  0
 19 17  2  0  0  0  0
 27 22  1  0  0  0  0
 21 31  1  0  0  0  0
M  END
>  <Mol_ID> (1,953)
1953

>  <Formula> (1,953)
C23H20ClN3O4S

>  <MolWeight> (1,953)
469.9406

>  <PCAT_CMPD_ID> (1,953)
WAY-385751

>  <CNC_ID> (1,953)
359412572

>  <transfer_container_id> (1,953)
PTN000000073

>  <COMPOUND_NUMBER> (1,953)
WAY-385751

>  <BAR_CODE_NO> (1,953)
2547796

>  <LOCATION_CODE> (1,953)
PTNCS

>  <AMOUNT_CURRENT> (1,953)
32.6

$$$$
WAY-385811
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  1  0  0  0  0
  9  7  1  0  0  0  0
 10  8  2  0  0  0  0
 11  5  1  0  0  0  0
 12 11  1  0  0  0  0
 13 15  2  0  0  0  0
 14 13  1  0  0  0  0
 15 12  1  0  0  0  0
 16 14  1  0  0  0  0
 17  8  1  0  0  0  0
 18 21  2  0  0  0  0
 19 10  1  0  0  0  0
 20 18  1  0  0  0  0
 21 15  1  0  0  0  0
 22 17  2  0  0  0  0
 23 22  1  0  0  0  0
 10  9  1  0  0  0  0
  6  5  2  0  0  0  0
 23 19  2  0  0  0  0
 14 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,954)
1954

>  <Formula> (1,954)
C17H12ClN3OS

>  <MolWeight> (1,954)
341.81468

>  <PCAT_CMPD_ID> (1,954)
WAY-385811

>  <CNC_ID> (1,954)
359412773

>  <transfer_container_id> (1,954)
PTN000000073

>  <COMPOUND_NUMBER> (1,954)
WAY-385811

>  <BAR_CODE_NO> (1,954)
2547852

>  <LOCATION_CODE> (1,954)
PTNCS

>  <AMOUNT_CURRENT> (1,954)
32.2

$$$$
WAY-385832
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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   -5.4270    8.8638    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0645   -2.2946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6895   -2.2946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3480   -0.1779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4855   -5.4821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9397   -8.2946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.9270    5.7304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0228    1.7221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1228    3.7554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3978   11.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  9  1  0  0  0  0
  5 18  1  0  0  0  0
  6  2  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
  9 10  1  0  0  0  0
 10  3  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  7  1  0  0  0  0
 14  8  1  0  0  0  0
 15  6  1  0  0  0  0
 16  4  1  0  0  0  0
 17  1  1  0  0  0  0
 18 16  1  0  0  0  0
 19  4  2  0  0  0  0
 20  5  2  0  0  0  0
 21 13  1  0  0  0  0
 22 14  1  0  0  0  0
 23 14  1  0  0  0  0
 24  3  1  0  0  0  0
 25 26  1  0  0  0  0
 26 24  2  0  0  0  0
 27 17  1  0  0  0  0
 25  9  2  0  0  0  0
 23 13  1  0  0  0  0
 22 15  1  0  0  0  0
 15 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,955)
1955

>  <Formula> (1,955)
C20H25NO5S

>  <MolWeight> (1,955)
391.4812

>  <PCAT_CMPD_ID> (1,955)
WAY-385832

>  <CNC_ID> (1,955)
359412793

>  <transfer_container_id> (1,955)
PTN000000073

>  <COMPOUND_NUMBER> (1,955)
WAY-385832

>  <BAR_CODE_NO> (1,955)
2547948

>  <LOCATION_CODE> (1,955)
PTNCS

>  <AMOUNT_CURRENT> (1,955)
32.2

$$$$
WAY-385860
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
    8.0500   -8.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3875   -8.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1542   -9.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1750   -7.0792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4125   -8.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4292   -7.5042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5000   -9.5750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.5167  -11.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3667  -10.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8000  -11.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3792  -13.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0625   -5.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7417   -5.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9750  -15.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3917  -15.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1167  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  1  0  0  0  0
  9  7  1  0  0  0  0
 10  8  2  0  0  0  0
 11  5  1  0  0  0  0
 12 13  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  2  0  0  0  0
 15 12  1  0  0  0  0
 16  8  1  0  0  0  0
 17 10  1  0  0  0  0
 18 15  1  0  0  0  0
 19 15  2  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
 22 18  2  0  0  0  0
 23 19  1  0  0  0  0
 24 23  2  0  0  0  0
 10  9  1  0  0  0  0
  6  5  2  0  0  0  0
 21 17  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,956)
1956

>  <Formula> (1,956)
C18H13N3O2S

>  <MolWeight> (1,956)
335.37972

>  <PCAT_CMPD_ID> (1,956)
WAY-385860

>  <CNC_ID> (1,956)
359412821

>  <transfer_container_id> (1,956)
PTN000000073

>  <COMPOUND_NUMBER> (1,956)
WAY-385860

>  <BAR_CODE_NO> (1,956)
2547932

>  <LOCATION_CODE> (1,956)
PTNCS

>  <AMOUNT_CURRENT> (1,956)
30.02

$$$$
WAY-385983
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.6375   -0.0917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5292   -0.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3292    1.4500    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2292    1.7833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9042    2.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1542   -5.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -3.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1042   -7.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2417   -5.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2875   -3.6542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4125   -5.3167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4792   -1.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4042   -1.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1250   -8.6792    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4250    2.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1417   -3.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4333    4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -5.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  9  1  0  0  0  0
  7 13  1  0  0  0  0
  8  6  2  0  0  0  0
  9 10  1  0  0  0  0
 10  7  1  0  0  0  0
 11  7  2  0  0  0  0
 12  2  1  0  0  0  0
 13 12  1  0  0  0  0
 14  8  1  0  0  0  0
 15  4  2  0  0  0  0
 16  5  2  0  0  0  0
 17  6  1  0  0  0  0
 18  8  1  0  0  0  0
 19 17  2  0  0  0  0
 20 21  2  0  0  0  0
 21 15  1  0  0  0  0
 22 19  1  0  0  0  0
  3  5  1  0  0  0  0
 16 20  1  0  0  0  0
 18 22  2  0  0  0  0
M  END
>  <Mol_ID> (1,957)
1957

>  <Formula> (1,957)
C17H14FNO2S

>  <MolWeight> (1,957)
315.3619632

>  <PCAT_CMPD_ID> (1,957)
WAY-385983

>  <CNC_ID> (1,957)
359412943

>  <transfer_container_id> (1,957)
PTN000000073

>  <COMPOUND_NUMBER> (1,957)
WAY-385983

>  <BAR_CODE_NO> (1,957)
2548020

>  <LOCATION_CODE> (1,957)
PTNCS

>  <AMOUNT_CURRENT> (1,957)
32.4

$$$$
WAY-386174
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    8.6042  -12.3667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1125   -3.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5292  -10.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3000    0.6083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3083   -3.0917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.7500  -14.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6042  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6917  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8  2  2  0  0  0  0
  9  3  2  0  0  0  0
 10  4  2  0  0  0  0
 11  4  1  0  0  0  0
 12  5  2  0  0  0  0
 13  5  1  0  0  0  0
 14  3  1  0  0  0  0
 15 17  1  0  0  0  0
 16 19  1  0  0  0  0
 17 11  2  0  0  0  0
 18 10  1  0  0  0  0
 19 13  2  0  0  0  0
 20 12  1  0  0  0  0
 21  1  1  0  0  0  0
 22  1  1  0  0  0  0
 23 16  1  0  0  0  0
 24 22  1  0  0  0  0
 25 21  1  0  0  0  0
 26 24  1  0  0  0  0
 25 26  1  0  0  0  0
 15 18  2  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,958)
1958

>  <Formula> (1,958)
C20H22N2O4

>  <MolWeight> (1,958)
354.39968

>  <PCAT_CMPD_ID> (1,958)
WAY-386174

>  <CNC_ID> (1,958)
359413117

>  <transfer_container_id> (1,958)
PTN000000073

>  <COMPOUND_NUMBER> (1,958)
WAY-386174

>  <BAR_CODE_NO> (1,958)
2548301

>  <LOCATION_CODE> (1,958)
PTNCS

>  <AMOUNT_CURRENT> (1,958)
32.3

$$$$
WAY-386180
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    5.7417   -3.5042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1542   -2.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9167   -2.0792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7417   -2.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6750   -2.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6750   -4.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2625   -3.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  2  2  0  0  0  0
 11  8  2  0  0  0  0
 12  9  1  0  0  0  0
 13 17  2  0  0  0  0
 14 12  1  0  0  0  0
 15 12  2  0  0  0  0
 16 14  2  0  0  0  0
 17 15  1  0  0  0  0
 18  4  1  0  0  0  0
 19  5  2  0  0  0  0
 20  6  2  0  0  0  0
 21 13  1  0  0  0  0
 22 19  1  0  0  0  0
 23 22  2  0  0  0  0
  3  4  2  0  0  0  0
 20 23  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,959)
1959

>  <Formula> (1,959)
C18H17N3O2

>  <MolWeight> (1,959)
307.34648

>  <PCAT_CMPD_ID> (1,959)
WAY-386180

>  <CNC_ID> (1,959)
359413123

>  <transfer_container_id> (1,959)
PTN000000073

>  <COMPOUND_NUMBER> (1,959)
WAY-386180

>  <BAR_CODE_NO> (1,959)
2548287

>  <LOCATION_CODE> (1,959)
PTNCS

>  <AMOUNT_CURRENT> (1,959)
32.8

$$$$
WAY-386220
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
   10.0417   -8.9667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.4542   -9.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5625   -7.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0875   -6.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9167   -6.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3250   -9.3875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7542   -8.5500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  4  5  2  0  0  0  0
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  7  1  2  0  0  0  0
  8  1  1  0  0  0  0
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 10  9  1  0  0  0  0
 11 16  2  0  0  0  0
 12 18  1  0  0  0  0
 13  3  2  0  0  0  0
 14  2  1  0  0  0  0
 15  2  2  0  0  0  0
 16 19  1  0  0  0  0
 17  4  1  0  0  0  0
 18  8  1  0  0  0  0
 19 10  2  0  0  0  0
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 24 23  1  0  0  0  0
 21 23  1  0  0  0  0
  4 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,960)
1960

>  <Formula> (1,960)
C16H16Cl2N2O3S

>  <MolWeight> (1,960)
387.28084

>  <PCAT_CMPD_ID> (1,960)
WAY-386220

>  <CNC_ID> (1,960)
359413163

>  <transfer_container_id> (1,960)
PTN000000073

>  <COMPOUND_NUMBER> (1,960)
WAY-386220

>  <BAR_CODE_NO> (1,960)
2548365

>  <LOCATION_CODE> (1,960)
PTNCS

>  <AMOUNT_CURRENT> (1,960)
33

$$$$
WAY-386315
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  5  2  0  0  0  0
 10 12  2  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14 13  1  0  0  0  0
 15  3  2  0  0  0  0
 16  4  1  0  0  0  0
 17  7  2  0  0  0  0
 18  6  1  0  0  0  0
 19 20  2  0  0  0  0
 20 12  1  0  0  0  0
 21 19  1  0  0  0  0
 22 16  2  0  0  0  0
 23 15  1  0  0  0  0
 24 22  1  0  0  0  0
 25 23  2  0  0  0  0
  7  2  1  0  0  0  0
 24 18  2  0  0  0  0
 17 25  1  0  0  0  0
 13 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,961)
1961

>  <Formula> (1,961)
C20H14FNO2S

>  <MolWeight> (1,961)
351.3940632

>  <PCAT_CMPD_ID> (1,961)
WAY-386315

>  <CNC_ID> (1,961)
359413246

>  <transfer_container_id> (1,961)
PTN000000073

>  <COMPOUND_NUMBER> (1,961)
WAY-386315

>  <BAR_CODE_NO> (1,961)
2548387

>  <LOCATION_CODE> (1,961)
PTNCS

>  <AMOUNT_CURRENT> (1,961)
32.8

$$$$
WAY-386336
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  3  2  1  0  0  0  0
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  5  4  1  0  0  0  0
  6  7  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  1  0  0  0  0
  9 14  1  0  0  0  0
 10  8  2  0  0  0  0
 11  1  1  0  0  0  0
 12  8  1  0  0  0  0
 13 12  2  0  0  0  0
 14 23  1  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17  3  1  0  0  0  0
 18 14  2  0  0  0  0
 19  6  1  0  0  0  0
 20  6  1  0  0  0  0
 21  6  1  0  0  0  0
 22 16  1  0  0  0  0
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 29 28  2  0  0  0  0
  5  3  2  0  0  0  0
 29 27  1  0  0  0  0
  7 15  2  0  0  0  0
M  END
>  <Mol_ID> (1,962)
1962

>  <Formula> (1,962)
C17H13ClF3N5OS2

>  <MolWeight> (1,962)
459.8962296

>  <PCAT_CMPD_ID> (1,962)
WAY-386336

>  <CNC_ID> (1,962)
359413267

>  <transfer_container_id> (1,962)
PTN000000073

>  <COMPOUND_NUMBER> (1,962)
WAY-386336

>  <BAR_CODE_NO> (1,962)
2548404

>  <LOCATION_CODE> (1,962)
PTNCS

>  <AMOUNT_CURRENT> (1,962)
32.4

$$$$
WAY-386584
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
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 20 23  1  0  0  0  0
  5  7  2  0  0  0  0
  9 14  1  0  0  0  0
 15 17  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,963)
1963

>  <Formula> (1,963)
C17H18N4OS

>  <MolWeight> (1,963)
326.41602

>  <PCAT_CMPD_ID> (1,963)
WAY-386584

>  <CNC_ID> (1,963)
359413326

>  <transfer_container_id> (1,963)
PTN000000073

>  <COMPOUND_NUMBER> (1,963)
WAY-386584

>  <BAR_CODE_NO> (1,963)
2548428

>  <LOCATION_CODE> (1,963)
PTNCS

>  <AMOUNT_CURRENT> (1,963)
32.9

$$$$
WAY-386663
csChFnd80/10111816222D

 28 29  0  0  0  0  0  0  0  0999 V2000
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 23 12  1  0  0  0  0
 24  9  1  0  0  0  0
 25  6  1  0  0  0  0
 26 14  1  0  0  0  0
 27 22  1  0  0  0  0
 28 23  1  0  0  0  0
  6  3  1  0  0  0  0
 27 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,964)
1964

>  <Formula> (1,964)
C16H10Cl3F3N2O3S

>  <MolWeight> (1,964)
473.6814096

>  <PCAT_CMPD_ID> (1,964)
WAY-386663

>  <CNC_ID> (1,964)
359413404

>  <transfer_container_id> (1,964)
PTN000000073

>  <COMPOUND_NUMBER> (1,964)
WAY-386663

>  <BAR_CODE_NO> (1,964)
2548511

>  <LOCATION_CODE> (1,964)
PTNCS

>  <AMOUNT_CURRENT> (1,964)
33

$$$$
WAY-386712
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6 19  1  0  0  0  0
  7  5  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10 14  1  0  0  0  0
 11  2  1  0  0  0  0
 12  6  1  0  0  0  0
 13  2  2  0  0  0  0
 14 21  1  0  0  0  0
 15  6  2  0  0  0  0
 16  7  1  0  0  0  0
 17  9  1  0  0  0  0
 18  7  1  0  0  0  0
 19 11  1  0  0  0  0
 20 12  1  0  0  0  0
 21 26  2  0  0  0  0
 22 10  1  0  0  0  0
 23 10  1  0  0  0  0
 24 20  1  0  0  0  0
 25 20  2  0  0  0  0
 26 25  1  0  0  0  0
 27 24  2  0  0  0  0
  9 18  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
 27 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,965)
1965

>  <Formula> (1,965)
C20H23F2NO4

>  <MolWeight> (1,965)
379.3977264

>  <PCAT_CMPD_ID> (1,965)
WAY-386712

>  <CNC_ID> (1,965)
359413452

>  <transfer_container_id> (1,965)
PTN000000073

>  <COMPOUND_NUMBER> (1,965)
WAY-386712

>  <BAR_CODE_NO> (1,965)
2548579

>  <LOCATION_CODE> (1,965)
PTNCS

>  <AMOUNT_CURRENT> (1,965)
29.3

$$$$
WAY-386759
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    8.9792   -5.1042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  1  1  0  0  0  0
  7 11  1  0  0  0  0
  8  4  1  0  0  0  0
  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11 18  1  0  0  0  0
 12 10  1  0  0  0  0
 13  2  1  0  0  0  0
 14  6  2  0  0  0  0
 15 25  1  0  0  0  0
 16 11  2  0  0  0  0
 17  9  1  0  0  0  0
 18  8  1  0  0  0  0
 19 21  1  0  0  0  0
 20 10  1  0  0  0  0
 21 17  2  0  0  0  0
 22 19  1  0  0  0  0
 23  6  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 26 13  2  0  0  0  0
 27 13  1  0  0  0  0
 28 14  1  0  0  0  0
 29 14  1  0  0  0  0
 30 23  2  0  0  0  0
 31 30  1  0  0  0  0
  5  3  1  0  0  0  0
 29 31  2  0  0  0  0
 24 15  2  0  0  0  0
 12 19  2  0  0  0  0
M  END
>  <Mol_ID> (1,966)
1966

>  <Formula> (1,966)
C22H17BrFN5OS

>  <MolWeight> (1,966)
498.3706832

>  <PCAT_CMPD_ID> (1,966)
WAY-386759

>  <CNC_ID> (1,966)
359413487

>  <transfer_container_id> (1,966)
PTN000000073

>  <COMPOUND_NUMBER> (1,966)
WAY-386759

>  <BAR_CODE_NO> (1,966)
2548658

>  <LOCATION_CODE> (1,966)
PTNCS

>  <AMOUNT_CURRENT> (1,966)
32.9

$$$$
WAY-386776
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   -0.5333   -4.1042    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  9  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10 11  1  0  0  0  0
 11  1  1  0  0  0  0
 12  5  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17 12  2  0  0  0  0
 18 12  1  0  0  0  0
 19 15  1  0  0  0  0
 20 10  2  0  0  0  0
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 22 11  2  0  0  0  0
 23 18  1  0  0  0  0
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 25 26  2  0  0  0  0
 26 22  1  0  0  0  0
 27 23  1  0  0  0  0
  4 10  1  0  0  0  0
 20 25  1  0  0  0  0
  6  7  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,967)
1967

>  <Formula> (1,967)
C19H20N2O4S2

>  <MolWeight> (1,967)
404.5031

>  <PCAT_CMPD_ID> (1,967)
WAY-386776

>  <CNC_ID> (1,967)
359413504

>  <transfer_container_id> (1,967)
PTN000000073

>  <COMPOUND_NUMBER> (1,967)
WAY-386776

>  <BAR_CODE_NO> (1,967)
2548711

>  <LOCATION_CODE> (1,967)
PTNCS

>  <AMOUNT_CURRENT> (1,967)
32.4

$$$$
WAY-386779
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
    3.7320    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2 11  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  9  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 17  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,968)
1968

>  <Formula> (1,968)
C12H13N3O2

>  <MolWeight> (1,968)
231.25052

>  <PCAT_CMPD_ID> (1,968)
WAY-386779

>  <CNC_ID> (1,968)
359413507

>  <transfer_container_id> (1,968)
PTN000000073

>  <COMPOUND_NUMBER> (1,968)
WAY-386779

>  <BAR_CODE_NO> (1,968)
2548703

>  <LOCATION_CODE> (1,968)
PTNCS

>  <AMOUNT_CURRENT> (1,968)
33

$$$$
WAY-386802
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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    0.6614    1.5449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0595    1.4907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0845   -0.7009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0595   -1.7551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2303    0.1074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4155    2.0366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9572    0.2616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8386    1.8282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9947   -0.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8345    1.4824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2428   -0.2426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4447    1.7741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0386    0.4449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7239    0.7616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  2  0  0  0  0
  6  1  1  0  0  0  0
  7 11  3  0  0  0  0
  8 12  3  0  0  0  0
  9  6  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 13  1  0  0  0  0
 13 17  2  0  0  0  0
 14  2  1  0  0  0  0
 15  3  1  0  0  0  0
 16  6  2  0  0  0  0
 17 16  1  0  0  0  0
 18 15  1  0  0  0  0
 19 14  1  0  0  0  0
 20 14  2  0  0  0  0
 21 15  2  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
 24 18  2  0  0  0  0
 25 19  2  0  0  0  0
 26 24  1  0  0  0  0
 27 22  2  0  0  0  0
  5  4  1  0  0  0  0
 13 10  1  0  0  0  0
 26 23  2  0  0  0  0
 27 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,969)
1969

>  <Formula> (1,969)
C22H13N5

>  <MolWeight> (1,969)
347.37212

>  <PCAT_CMPD_ID> (1,969)
WAY-386802

>  <CNC_ID> (1,969)
359413528

>  <transfer_container_id> (1,969)
PTN000000073

>  <COMPOUND_NUMBER> (1,969)
WAY-386802

>  <BAR_CODE_NO> (1,969)
2548531

>  <LOCATION_CODE> (1,969)
PTNCS

>  <AMOUNT_CURRENT> (1,969)
32.3

$$$$
WAY-386930
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
   -0.1625   -0.4375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8833   -0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8833    0.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5542   -0.8500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958    1.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5875    2.0458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5833   -1.1542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2542    0.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6000   -0.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3000    2.4625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6917    2.0583    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3208    0.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2667   -0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3208   -0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8708    2.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2625    0.3958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6000   -1.2542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9792    0.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9792    1.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5542   -1.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4125    1.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8875   -1.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6917    0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4125    0.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  2  0  0  0  0
  9  2  2  0  0  0  0
 10  6  2  0  0  0  0
 11 19  2  0  0  0  0
 12 14  2  0  0  0  0
 13  4  1  0  0  0  0
 14  9  1  0  0  0  0
 15  6  1  0  0  0  0
 16 13  1  0  0  0  0
 17  9  1  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20  4  1  0  0  0  0
 21 24  2  0  0  0  0
 22 17  1  0  0  0  0
 23 18  2  0  0  0  0
 24 23  1  0  0  0  0
  5 12  1  0  0  0  0
 11 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,970)
1970

>  <Formula> (1,970)
C16H18N2O5S

>  <MolWeight> (1,970)
350.38952

>  <PCAT_CMPD_ID> (1,970)
WAY-386930

>  <CNC_ID> (1,970)
359413661

>  <transfer_container_id> (1,970)
PTN000000073

>  <COMPOUND_NUMBER> (1,970)
WAY-386930

>  <BAR_CODE_NO> (1,970)
2548959

>  <LOCATION_CODE> (1,970)
PTNCS

>  <AMOUNT_CURRENT> (1,970)
32.9

$$$$
WAY-386976
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    6.4792   -7.2667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000   -7.2625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8292   -6.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1000   -8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9917   -5.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1542   -6.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1125   -7.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4292   -7.3292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5417   -8.2917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7042   -8.8167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8250   -5.9542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9542  -10.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5417   -7.0667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3792   -9.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9417  -10.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7167   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7750   -8.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3417   -9.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792   -4.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3167   -9.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7542   -8.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5667  -11.0250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2042   -5.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4000   -9.1625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2667   -9.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5625  -10.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9292   -4.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0917   -4.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  7  1  0  0  0  0
 11  3  2  0  0  0  0
 12 15  1  0  0  0  0
 13  7  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 10  1  0  0  0  0
 17 21  2  0  0  0  0
 18 20  1  0  0  0  0
 19  5  1  0  0  0  0
 20 16  1  0  0  0  0
 21 18  1  0  0  0  0
 22 12  1  0  0  0  0
 23  6  1  0  0  0  0
 24 14  1  0  0  0  0
 25 10  1  0  0  0  0
 26 22  1  0  0  0  0
 27 24  1  0  0  0  0
 28 29  1  0  0  0  0
 29 23  2  0  0  0  0
  3  5  1  0  0  0  0
 28 19  2  0  0  0  0
 14 12  2  0  0  0  0
M  END
>  <Mol_ID> (1,971)
1971

>  <Formula> (1,971)
C20H22N2O6S

>  <MolWeight> (1,971)
418.46348

>  <PCAT_CMPD_ID> (1,971)
WAY-386976

>  <CNC_ID> (1,971)
359413706

>  <transfer_container_id> (1,971)
PTN000000073

>  <COMPOUND_NUMBER> (1,971)
WAY-386976

>  <BAR_CODE_NO> (1,971)
2548882

>  <LOCATION_CODE> (1,971)
PTNCS

>  <AMOUNT_CURRENT> (1,971)
32

$$$$
WAY-387108
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   11.9792   -9.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8292   -9.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2500   -8.4792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5542  -10.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1042   -8.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5375   -8.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7042  -10.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5042   -7.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2667  -10.4542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0250   -6.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2667   -9.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6917   -8.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9875  -11.4500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4917   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4167   -9.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5125   -9.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2917   -7.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8292  -11.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2875   -5.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0542   -4.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7125   -8.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3125   -9.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6667   -4.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4500   -3.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3042   -3.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  4  1  0  0  0  0
  8  5  2  0  0  0  0
  9  2  2  0  0  0  0
 10  8  1  0  0  0  0
 11 12  1  0  0  0  0
 12  6  2  0  0  0  0
 13  4  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16  5  1  0  0  0  0
 17  8  1  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 20 14  2  0  0  0  0
 21 15  1  0  0  0  0
 22 23  1  0  0  0  0
 23 16  2  0  0  0  0
 24 19  2  0  0  0  0
 25 20  1  0  0  0  0
 26 25  2  0  0  0  0
 11  7  2  0  0  0  0
 17 22  2  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,972)
1972

>  <Formula> (1,972)
C22H21NO3

>  <MolWeight> (1,972)
347.40704

>  <PCAT_CMPD_ID> (1,972)
WAY-387108

>  <CNC_ID> (1,972)
359413786

>  <transfer_container_id> (1,972)
PTN000000073

>  <COMPOUND_NUMBER> (1,972)
WAY-387108

>  <BAR_CODE_NO> (1,972)
2548920

>  <LOCATION_CODE> (1,972)
PTNCS

>  <AMOUNT_CURRENT> (1,972)
28.9

$$$$
WAY-387802
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   12.1792  -12.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8000  -11.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0792  -11.5375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7292  -12.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8250  -13.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0917  -13.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8917  -12.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2542  -11.5750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -12.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2792  -13.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9667  -11.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7042  -10.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2000  -14.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7417  -14.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3125  -10.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292  -10.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9500   -9.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8375  -15.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1167  -15.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3875   -9.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3125   -8.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292   -8.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  6  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  4  2  0  0  0  0
 10  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  3  1  0  0  0  0
 13  5  2  0  0  0  0
 14  6  2  0  0  0  0
 15 11  1  0  0  0  0
 16 15  1  0  0  0  0
 17 15  2  0  0  0  0
 18 13  1  0  0  0  0
 19 18  2  0  0  0  0
 20 16  2  0  0  0  0
 21 17  1  0  0  0  0
 22 21  2  0  0  0  0
  4  3  1  0  0  0  0
 14 19  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,973)
1973

>  <Formula> (1,973)
C17H15N3O2

>  <MolWeight> (1,973)
293.3199

>  <PCAT_CMPD_ID> (1,973)
WAY-387802

>  <CNC_ID> (1,973)
359413874

>  <transfer_container_id> (1,973)
PTN000000073

>  <COMPOUND_NUMBER> (1,973)
WAY-387802

>  <BAR_CODE_NO> (1,973)
2549735

>  <LOCATION_CODE> (1,973)
PTNCS

>  <AMOUNT_CURRENT> (1,973)
32.6

$$$$
WAY-387841
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    6.0792    3.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6875    3.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8792    3.6333    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1917    4.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7917    4.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9917    4.8792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7792    2.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792    2.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6667    4.8917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9042    6.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9792    2.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2167    7.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3167    6.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9917    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0042    6.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3417    8.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9292    8.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0292    7.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0542    9.7250    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    6.0750    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6625    6.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6625    3.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8667    1.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7542    0.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1542    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  2  0  0  0  0
  9  6  1  0  0  0  0
 10  4  1  0  0  0  0
 11  2  2  0  0  0  0
 12 22  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15  9  1  0  0  0  0
 16  9  1  0  0  0  0
 17 19  2  0  0  0  0
 18 13  2  0  0  0  0
 19 14  1  0  0  0  0
 20 17  1  0  0  0  0
 21  7  1  0  0  0  0
 22 16  1  0  0  0  0
 23 15  1  0  0  0  0
 24  8  1  0  0  0  0
 25 21  2  0  0  0  0
 26 25  1  0  0  0  0
  3  4  2  0  0  0  0
 24 26  2  0  0  0  0
 17 18  1  0  0  0  0
 12 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,974)
1974

>  <Formula> (1,974)
C20H18BrN3O2

>  <MolWeight> (1,974)
412.27982

>  <PCAT_CMPD_ID> (1,974)
WAY-387841

>  <CNC_ID> (1,974)
359413912

>  <transfer_container_id> (1,974)
PTN000000073

>  <COMPOUND_NUMBER> (1,974)
WAY-387841

>  <BAR_CODE_NO> (1,974)
2549925

>  <LOCATION_CODE> (1,974)
PTNCS

>  <AMOUNT_CURRENT> (1,974)
32.3

$$$$
WAY-388000
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
    6.8417   -3.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2292   -2.8667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.2292   -4.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2417   -4.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8875   -3.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2417   -3.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4625   -6.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8667   -7.5750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4042   -4.6042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9792   -5.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4125   -2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4292   -6.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0917   -5.7625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5542   -5.5500    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.9250   -7.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0292   -5.5042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4542   -6.4042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4542   -4.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3417   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3417   -2.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2417   -8.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5667   -6.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3167   -8.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4375   -4.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4375   -3.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3500   -8.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6000   -7.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7 12  1  0  0  0  0
  8  7  1  0  0  0  0
  9  5  1  0  0  0  0
 10 18  1  0  0  0  0
 11  5  2  0  0  0  0
 12 16  1  0  0  0  0
 13  7  2  0  0  0  0
 14  3  1  0  0  0  0
 15  8  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18  9  1  0  0  0  0
 19  4  2  0  0  0  0
 20  6  2  0  0  0  0
 21  8  1  0  0  0  0
 22 15  2  0  0  0  0
 23 15  1  0  0  0  0
 24 19  1  0  0  0  0
 25 20  1  0  0  0  0
 26 23  2  0  0  0  0
 27 22  1  0  0  0  0
 28 26  1  0  0  0  0
  6  4  1  0  0  0  0
 25 24  2  0  0  0  0
 27 28  2  0  0  0  0
M  END
>  <Mol_ID> (1,975)
1975

>  <Formula> (1,975)
C20H17ClN2O4S

>  <MolWeight> (1,975)
416.87798

>  <PCAT_CMPD_ID> (1,975)
WAY-388000

>  <CNC_ID> (1,975)
359414054

>  <transfer_container_id> (1,975)
PTN000000073

>  <COMPOUND_NUMBER> (1,975)
WAY-388000

>  <BAR_CODE_NO> (1,975)
2549954

>  <LOCATION_CODE> (1,975)
PTNCS

>  <AMOUNT_CURRENT> (1,975)
32.8

$$$$
WAY-388237
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    2.8601    3.7963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1501    4.9855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1098    7.3842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8197    6.1905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4503    2.5824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7167    7.3574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2442    3.8231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8018    8.5825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9923    2.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.5422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1837    2.5891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1894    1.2901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7593    4.9609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0470    6.1502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4503    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.1894    3.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0762    9.7942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6764    9.7718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6474    1.2901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6586    3.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3843    2.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  2  0  0  0  0
  4  2  1  0  0  0  0
  5  9  1  0  0  0  0
  6 14  2  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11  1  2  0  0  0  0
 12  5  2  0  0  0  0
 13  2  2  0  0  0  0
 14 13  1  0  0  0  0
 15 12  1  0  0  0  0
 16  5  1  0  0  0  0
 17  8  1  0  0  0  0
 18 10  1  0  0  0  0
 19 12  1  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
  3  6  1  0  0  0  0
 21 19  2  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,976)
1976

>  <Formula> (1,976)
C16H13FO4

>  <MolWeight> (1,976)
288.2704232

>  <PCAT_CMPD_ID> (1,976)
WAY-388237

>  <CNC_ID> (1,976)
359414276

>  <transfer_container_id> (1,976)
PTN000000073

>  <COMPOUND_NUMBER> (1,976)
WAY-388237

>  <BAR_CODE_NO> (1,976)
2550191

>  <LOCATION_CODE> (1,976)
PTNCS

>  <AMOUNT_CURRENT> (1,976)
32.2

$$$$
WL-164379
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -3.5157   -3.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5405   -1.8602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1144   -3.8258    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7497   -4.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1330   -1.2463    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7993   -0.9983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1533   -2.5236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1386   -3.3545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1758   -1.7796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3782   -2.5112    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5151   -1.0169    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8743   -1.0479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4182   -1.0355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1871    0.3224    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1871   -2.3376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7249    0.3472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4813    1.6928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5185   -0.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0191    1.7114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6877    3.0135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0563   -0.9487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7683   -2.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8066    0.3906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6736    4.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7852   -3.4723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
 22 25  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,977)
1977

>  <Formula> (1,977)
C19H21N3OS2

>  <MolWeight> (1,977)
371.51954

>  <PCAT_CMPD_ID> (1,977)
WL-164379

>  <CNC_ID> (1,977)
359419942

>  <transfer_container_id> (1,977)
PTN000000073

>  <COMPOUND_NUMBER> (1,977)
WL-164379

>  <BAR_CODE_NO> (1,977)
3909529

>  <LOCATION_CODE> (1,977)
PTNCS

>  <AMOUNT_CURRENT> (1,977)
33.3

$$$$
WL-189258
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   -1.7404   -0.6578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3818   -0.2164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7404   -2.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9852    0.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0562    1.1387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4562   -1.3751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3818   -2.5337    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9852   -2.8095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2231   -0.6578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4596    1.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8956    2.2042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8872   -1.3751    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2231   -2.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9010    2.8008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148    0.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3044    3.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8182    0.6698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2596    2.0353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  2  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  6  7  1  0  0  0  0
  9 13  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (1,978)
1978

>  <Formula> (1,978)
C15H15NOS

>  <MolWeight> (1,978)
257.3507

>  <PCAT_CMPD_ID> (1,978)
WL-189258

>  <CNC_ID> (1,978)
359419949

>  <transfer_container_id> (1,978)
PTN000000073

>  <COMPOUND_NUMBER> (1,978)
WL-189258

>  <BAR_CODE_NO> (1,978)
3909812

>  <LOCATION_CODE> (1,978)
PTNCS

>  <AMOUNT_CURRENT> (1,978)
33.8

$$$$
CL-278217
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.5873   -0.2761    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.0554   -0.7406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6486    0.6179    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3068   -1.5120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0650    1.1877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0554   -2.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3833    0.0131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4908    2.1650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0685    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5873   -2.7654    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8538   -1.5120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3833   -3.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7331   -0.7406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7442    3.0590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9116    2.7829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3219    0.8940    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -4.7331   -2.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1554    2.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7331    0.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  8 15  2  0  0  0  0
  9 16  1  0  0  0  0
 12 17  2  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
  6 10  1  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (1,979)
1979

>  <Formula> (1,979)
C15H17NO3

>  <MolWeight> (1,979)
259.30038

>  <PCAT_CMPD_ID> (1,979)
CL-278217

>  <CNC_ID> (1,979)
359419964

>  <transfer_container_id> (1,979)
PTN000000074

>  <COMPOUND_NUMBER> (1,979)
CL-278217

>  <BAR_CODE_NO> (1,979)
3911923

>  <LOCATION_CODE> (1,979)
PTNCS

>  <AMOUNT_CURRENT> (1,979)
33.3

$$$$
CL-400846
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
    0.2505   -0.6806    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1536    0.5860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4063   -0.1981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6672    0.5860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9222   -0.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7246   -0.3751    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2813    0.2392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9735    1.9905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2235    1.1947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8015    0.1030    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3723   -1.2512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1598   -1.5053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1973   -0.4512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3348   -2.3095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6390    1.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  4  5  2  0  0  0  0
  2  3  2  0  0  0  0
  5  6  1  0  0  0  0
  1  5  1  0  0  0  0
  6  7  2  0  0  0  0
  9 10  2  0  0  0  0
 10  8  1  0  0  0  0
  3 14  1  0  0  0  0
  4  2  1  0  0  0  0
 14 12  1  0  0  0  0
  7  8  1  0  0  0  0
 12 13  1  0  0  0  0
  3  1  1  0  0  0  0
 11 14  2  0  0  0  0
 10  4  1  0  0  0  0
 13 15  1  0  0  0  0
  2 16  1  0  0  0  0
M  END
>  <Mol_ID> (1,980)
1980

>  <Formula> (1,980)
C10H10N2O3S

>  <MolWeight> (1,980)
238.263

>  <PCAT_CMPD_ID> (1,980)
CL-400846

>  <CNC_ID> (1,980)
359419982

>  <transfer_container_id> (1,980)
PTN000000074

>  <COMPOUND_NUMBER> (1,980)
CL-400846

>  <BAR_CODE_NO> (1,980)
3912495

>  <LOCATION_CODE> (1,980)
PTNCS

>  <AMOUNT_CURRENT> (1,980)
33

$$$$
CL-418172
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
    1.0263   -0.0092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2912    0.7535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0263   -1.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4964    0.4623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6319   -0.0092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2912    2.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2912   -2.3346    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4964   -2.0387    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.3932   -0.7582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9587    1.9370    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6319   -1.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633    0.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6319    3.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9142   -0.7582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633   -2.3346    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633    2.3207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1202    3.3054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8677    4.5998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139   -2.1404    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139    0.5732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633   -3.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2947   -1.5579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2947   -4.5998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6261   -2.3808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6261   -3.8417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 14 20  2  0  0  0  0
 15 21  1  0  0  0  0
 15 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  1  0  0  0  0
 13 16  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,981)
1981

>  <Formula> (1,981)
C17H22N4O3S

>  <MolWeight> (1,981)
362.44658

>  <PCAT_CMPD_ID> (1,981)
CL-418172

>  <CNC_ID> (1,981)
359420012

>  <transfer_container_id> (1,981)
PTN000000074

>  <COMPOUND_NUMBER> (1,981)
CL-418172

>  <BAR_CODE_NO> (1,981)
3912466

>  <LOCATION_CODE> (1,981)
PTNCS

>  <AMOUNT_CURRENT> (1,981)
33.8

$$$$
GI-532967
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   -0.6805    0.9138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6805   -0.6318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6610    1.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1483    1.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6610   -1.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1483   -1.1082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9830    0.9138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0329    0.1410    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9830   -0.6318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3099    1.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5785    0.1410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3099   -1.4047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6465    0.9138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5785    1.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1241    0.1410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5785   -1.4047    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.6465   -0.6318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0123   -1.4047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  2  0  0  0  0
 11 14  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 17 18  2  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
 13 17  1  0  0  0  0
M  END
>  <Mol_ID> (1,982)
1982

>  <Formula> (1,982)
C14H13ClO3

>  <MolWeight> (1,982)
264.70422

>  <PCAT_CMPD_ID> (1,982)
GI-532967

>  <CNC_ID> (1,982)
359420042

>  <transfer_container_id> (1,982)
PTN000000074

>  <COMPOUND_NUMBER> (1,982)
GI-532967

>  <BAR_CODE_NO> (1,982)
3913609

>  <LOCATION_CODE> (1,982)
PTNCS

>  <AMOUNT_CURRENT> (1,982)
33.5

$$$$
GI-559759
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
   -0.1759    0.5175    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1759   -0.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5966    0.9658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9552    0.9658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5966   -0.8238    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9552   -0.8238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3759    0.5175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5966    1.8589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7345    0.5175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3759   -0.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7345   -0.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9552   -1.7238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1448   -0.8238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  6 12  1  0  0  0  0
 10 13  1  0  0  0  0
  7 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <Mol_ID> (1,983)
1983

>  <Formula> (1,983)
C9H8N2O2

>  <MolWeight> (1,983)
176.17202

>  <PCAT_CMPD_ID> (1,983)
GI-559759

>  <CNC_ID> (1,983)
359420044

>  <transfer_container_id> (1,983)
PTN000000074

>  <COMPOUND_NUMBER> (1,983)
GI-559759

>  <BAR_CODE_NO> (1,983)
3913481

>  <LOCATION_CODE> (1,983)
PTNCS

>  <AMOUNT_CURRENT> (1,983)
33.3

$$$$
GI-570206
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    0.3473    1.9107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1197    1.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4148    1.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3473    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1197    0.5935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8921    1.9107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1769    1.9107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4148    0.5832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1197    3.2487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3680    0.1038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8749    0.1418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8921    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9389    1.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1769    0.1418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4059   -0.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9389    0.5832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3493   -1.2617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3493   -2.1582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1010   -0.8306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4335   -2.5996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0941   -2.5996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4507   -3.4755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0941   -3.4962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3217   -3.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
 10 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
  9 12  2  0  0  0  0
 14 16  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,984)
1984

>  <Formula> (1,984)
C21H16O3

>  <MolWeight> (1,984)
316.34994

>  <PCAT_CMPD_ID> (1,984)
GI-570206

>  <CNC_ID> (1,984)
359420051

>  <transfer_container_id> (1,984)
PTN000000074

>  <COMPOUND_NUMBER> (1,984)
GI-570206

>  <BAR_CODE_NO> (1,984)
3911494

>  <LOCATION_CODE> (1,984)
PTNCS

>  <AMOUNT_CURRENT> (1,984)
33.7

$$$$
WAY-113436
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.8687    0.2380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4100    0.2380    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9480    0.2380    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4100   -0.3033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0687    0.6898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0928   -0.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3100    0.6277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2307   -0.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2072    0.2104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8100    0.4208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7480   -0.1240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7520    0.2104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1072   -0.3723    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0313    0.6898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6210   -0.3723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8900   -0.8033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8900    0.0346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3831   -0.8033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3831    0.0484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6313   -0.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6313   -1.2792    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  2  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
  9 12  2  0  0  0  0
 13 14  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (1,985)
1985

>  <Formula> (1,985)
C17H17FN2O3S

>  <MolWeight> (1,985)
348.3918832

>  <PCAT_CMPD_ID> (1,985)
WAY-113436

>  <CNC_ID> (1,985)
359420076

>  <transfer_container_id> (1,985)
PTN000000074

>  <COMPOUND_NUMBER> (1,985)
WAY-113436

>  <BAR_CODE_NO> (1,985)
3911777

>  <LOCATION_CODE> (1,985)
PTNCS

>  <AMOUNT_CURRENT> (1,985)
33.8

$$$$
WAY-307502
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.2517   -0.2276    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.2000   -0.7759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7103   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2517    0.8828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2000   -1.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1552   -0.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7103   -1.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6931   -0.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2000    1.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7103    1.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2517   -2.4448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1552   -2.4448    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1172   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1552    0.7448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6931   -2.4552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6448   -0.7690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6931    0.9069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2000    2.5552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7310    2.5310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1172   -1.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6000   -0.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2517    3.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5621   -0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2379    4.2069    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  2  0  0  0  0
  9 18  1  0  0  0  0
 10 19  2  0  0  0  0
 12 20  1  0  0  0  0
 16 21  1  0  0  0  0
 18 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
  7 11  1  0  0  0  0
 13 20  1  0  0  0  0
 19 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,986)
1986

>  <Formula> (1,986)
C17H17FN2O3S

>  <MolWeight> (1,986)
348.3918832

>  <PCAT_CMPD_ID> (1,986)
WAY-307502

>  <CNC_ID> (1,986)
359420358

>  <transfer_container_id> (1,986)
PTN000000074

>  <COMPOUND_NUMBER> (1,986)
WAY-307502

>  <BAR_CODE_NO> (1,986)
3911300

>  <LOCATION_CODE> (1,986)
PTNCS

>  <AMOUNT_CURRENT> (1,986)
33.5

$$$$
WAY-307940
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.5828    0.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5828   -0.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0724    0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0966    0.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0724   -0.7207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5586    0.1586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0724    1.0414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6103    0.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5586   -0.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6000   -0.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0448    0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4655    0.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9793    0.4586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4655   -0.4345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4897    0.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4897   -0.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5103    0.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0034   -0.7207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5172   -0.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0241    0.4655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,987)
1987

>  <Formula> (1,987)
C16H13N3O3

>  <MolWeight> (1,987)
295.29272

>  <PCAT_CMPD_ID> (1,987)
WAY-307940

>  <CNC_ID> (1,987)
359420795

>  <transfer_container_id> (1,987)
PTN000000074

>  <COMPOUND_NUMBER> (1,987)
WAY-307940

>  <BAR_CODE_NO> (1,987)
3911816

>  <LOCATION_CODE> (1,987)
PTNCS

>  <AMOUNT_CURRENT> (1,987)
33.1

$$$$
WAY-307945
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -1.6276    0.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0517   -0.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8034    0.2379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0172    0.9655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6517   -1.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8690   -0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4034   -0.4828    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3759    0.9379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8517    0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8276   -1.1966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0759   -1.8828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2655    0.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4483    0.9241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4276   -1.9138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8483    0.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8724    1.6241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6690    0.1862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0586   -0.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0931    0.8862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8862   -0.5586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9103    0.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3172    0.1483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1448    0.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  2  0  0  0  0
  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
  7 10  1  0  0  0  0
  9 12  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (1,988)
1988

>  <Formula> (1,988)
C18H17N3O2

>  <MolWeight> (1,988)
307.34648

>  <PCAT_CMPD_ID> (1,988)
WAY-307945

>  <CNC_ID> (1,988)
359420800

>  <transfer_container_id> (1,988)
PTN000000074

>  <COMPOUND_NUMBER> (1,988)
WAY-307945

>  <BAR_CODE_NO> (1,988)
3911821

>  <LOCATION_CODE> (1,988)
PTNCS

>  <AMOUNT_CURRENT> (1,988)
33.8

$$$$
WAY-307958
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -1.0758    0.9696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0758    0.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206    1.2937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6378    1.2937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206   -0.0063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6378   -0.0063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206    1.9454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0415    0.9696    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1965    0.9696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0415    0.3247    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206   -0.6304    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1965    0.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0758    2.2730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7242   -2.5925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2760   -2.9270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2760   -3.5753    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8277   -2.5925    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
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  6 12  2  0  0  0  0
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 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
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 15 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 18 21  1  0  0  0  0
 19 22  2  0  0  0  0
 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
  8 10  2  0  0  0  0
  9 12  1  0  0  0  0
 17 20  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,989)
1989

>  <Formula> (1,989)
C22H18N4O2

>  <MolWeight> (1,989)
370.40392

>  <PCAT_CMPD_ID> (1,989)
WAY-307958

>  <CNC_ID> (1,989)
359420813

>  <transfer_container_id> (1,989)
PTN000000074

>  <COMPOUND_NUMBER> (1,989)
WAY-307958

>  <BAR_CODE_NO> (1,989)
3911834

>  <LOCATION_CODE> (1,989)
PTNCS

>  <AMOUNT_CURRENT> (1,989)
33.6

$$$$
WAY-307970
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.2931    1.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5034    1.1966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2552    1.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9931    2.6862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7345    1.7862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5552    0.6276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0241    2.6966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2069    1.4966    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4931    0.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9138   -0.0931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4172    0.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7931   -0.4828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1931   -1.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3345    0.2483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1345   -1.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5552   -0.6931    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0552    0.9069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4655   -0.9828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7069   -1.9241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1655   -0.3310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6276   -2.1931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0276   -2.6034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0966   -0.6034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3448   -1.5241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0966   -2.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7862    0.0586    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  2  0  0  0  0
 11 14  1  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  2  0  0  0  0
 21 24  2  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
  5  7  2  0  0  0  0
 13 15  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (1,990)
1990

>  <Formula> (1,990)
C18H16ClN3O3S

>  <MolWeight> (1,990)
389.85594

>  <PCAT_CMPD_ID> (1,990)
WAY-307970

>  <CNC_ID> (1,990)
359420824

>  <transfer_container_id> (1,990)
PTN000000074

>  <COMPOUND_NUMBER> (1,990)
WAY-307970

>  <BAR_CODE_NO> (1,990)
3911848

>  <LOCATION_CODE> (1,990)
PTNCS

>  <AMOUNT_CURRENT> (1,990)
33.7

$$$$
WAY-308040
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -0.9931    0.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9931   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5517    0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4138    0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5517   -0.5828    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4138   -0.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1310    0.1793    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5310    0.9379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8310    0.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1310   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8310   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3724    0.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3069   -0.6034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7483   -0.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690   -0.6207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7690    0.1586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6069   -0.3828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2069    0.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6276    0.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0276   -0.6414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2276    0.8966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0690    0.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  2  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,991)
1991

>  <Formula> (1,991)
C16H17N5O

>  <MolWeight> (1,991)
295.33908

>  <PCAT_CMPD_ID> (1,991)
WAY-308040

>  <CNC_ID> (1,991)
359420894

>  <transfer_container_id> (1,991)
PTN000000074

>  <COMPOUND_NUMBER> (1,991)
WAY-308040

>  <BAR_CODE_NO> (1,991)
3911929

>  <LOCATION_CODE> (1,991)
PTNCS

>  <AMOUNT_CURRENT> (1,991)
33.3

$$$$
WAY-308104
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.5276    0.1241    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2241   -0.3034    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5621    0.9276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2241   -0.2724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1483   -1.0724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7966   -0.8276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7276   -0.0724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1517    1.3759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9241    0.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3276   -1.5276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9621   -1.5241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8759    0.9759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3276   -2.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9483   -2.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6034    1.3759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1276   -2.9276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6034    2.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4241    0.9276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1483   -3.7759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8276    2.8966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3517    2.8724    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4276   -4.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1724    3.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1034    3.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 17 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
  9 12  1  0  0  0  0
 14 16  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (1,992)
1992

>  <Formula> (1,992)
C16H18N2O4S2

>  <MolWeight> (1,992)
366.45512

>  <PCAT_CMPD_ID> (1,992)
WAY-308104

>  <CNC_ID> (1,992)
359420958

>  <transfer_container_id> (1,992)
PTN000000074

>  <COMPOUND_NUMBER> (1,992)
WAY-308104

>  <BAR_CODE_NO> (1,992)
3912002

>  <LOCATION_CODE> (1,992)
PTNCS

>  <AMOUNT_CURRENT> (1,992)
33.7

$$$$
WAY-308121
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -2.8379    0.3483    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.2379    1.1862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3207    1.9034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1621   -0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7414    1.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586    0.5483    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6172    0.3621    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -4.3241   -1.3931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0621    0.3759    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4069   -0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5103   -1.3690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9276   -2.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4931    0.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2690    1.8138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8379   -1.0345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3966    1.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0103   -1.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8138    1.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4448   -1.3931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3448   -0.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7655   -0.4931    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
  9 15  2  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  6  7  1  0  0  0  0
  8 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (1,993)
1993

>  <Formula> (1,993)
C16H24N2O2S

>  <MolWeight> (1,993)
308.43896

>  <PCAT_CMPD_ID> (1,993)
WAY-308121

>  <CNC_ID> (1,993)
359420975

>  <transfer_container_id> (1,993)
PTN000000074

>  <COMPOUND_NUMBER> (1,993)
WAY-308121

>  <BAR_CODE_NO> (1,993)
3912028

>  <LOCATION_CODE> (1,993)
PTNCS

>  <AMOUNT_CURRENT> (1,993)
33.9

$$$$
WAY-308134
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.0345    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2103    0.0517    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6586    1.1138    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6586   -0.9862    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.8207    1.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8207   -1.0414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4966    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8724   -0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0621    1.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0621   -1.0414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7138    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6724    0.0517    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3345    1.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3345   -0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8793    0.0517    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5517    1.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5517   -0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0966    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8793    1.2552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8793   -1.1966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1793    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  2  0  0  0  0
 15 20  2  0  0  0  0
 16 21  1  0  0  0  0
  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (1,994)
1994

>  <Formula> (1,994)
C14H17N3O2S2

>  <MolWeight> (1,994)
323.43368

>  <PCAT_CMPD_ID> (1,994)
WAY-308134

>  <CNC_ID> (1,994)
359420988

>  <transfer_container_id> (1,994)
PTN000000074

>  <COMPOUND_NUMBER> (1,994)
WAY-308134

>  <BAR_CODE_NO> (1,994)
3912042

>  <LOCATION_CODE> (1,994)
PTNCS

>  <AMOUNT_CURRENT> (1,994)
33.8

$$$$
WAY-308211
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -0.8724    0.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8103    0.5138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3724   -0.1069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3897    1.5793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9103   -0.4483    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5345    1.1517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0103   -0.8207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5897   -0.2483    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5897    1.5793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4586    0.8517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3345    2.0931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9103   -1.7862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0655    0.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0655    2.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7103   -2.3690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0345   -2.1862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0276    0.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0276    2.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6103   -3.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0655   -3.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5103    1.5793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6966    0.0034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7103   -3.7207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4759    1.3793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5621    0.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  2  0  0  0  0
  9 14  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  2  0  0  0  0
 17 22  1  0  0  0  0
 19 23  2  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
  5  7  1  0  0  0  0
 18 21  1  0  0  0  0
 20 23  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (1,995)
1995

>  <Formula> (1,995)
C18H12N2O5

>  <MolWeight> (1,995)
336.29828

>  <PCAT_CMPD_ID> (1,995)
WAY-308211

>  <CNC_ID> (1,995)
359421065

>  <transfer_container_id> (1,995)
PTN000000074

>  <COMPOUND_NUMBER> (1,995)
WAY-308211

>  <BAR_CODE_NO> (1,995)
3912144

>  <LOCATION_CODE> (1,995)
PTNCS

>  <AMOUNT_CURRENT> (1,995)
33.4

$$$$
WAY-308239
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    1.4276    0.3931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8655   -0.3276    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2655    1.2931    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2862    0.0931    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3862   -1.0793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3862    1.6207    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2448   -0.8069    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1276   -1.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4724    1.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0655    0.7552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7069    2.4931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2276   -2.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1931    1.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6724   -2.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4448   -3.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0069   -1.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0345    1.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0345    0.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7345    1.0552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7138   -0.1448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5724    0.1552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  2  0  0  0  0
  6 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  2  0  0  0  0
 13 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
  5  7  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (1,996)
1996

>  <Formula> (1,996)
C14H19N3O2S2

>  <MolWeight> (1,996)
325.44956

>  <PCAT_CMPD_ID> (1,996)
WAY-308239

>  <CNC_ID> (1,996)
359421093

>  <transfer_container_id> (1,996)
PTN000000074

>  <COMPOUND_NUMBER> (1,996)
WAY-308239

>  <BAR_CODE_NO> (1,996)
3912173

>  <LOCATION_CODE> (1,996)
PTNCS

>  <AMOUNT_CURRENT> (1,996)
33.4

$$$$
WAY-308820
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.0034   -0.2931    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.0034    0.4552    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586   -0.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6552   -0.6690    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4207    1.0345    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3034    0.4552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586   -1.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2828   -0.2931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3034   -0.2931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1586    1.6241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3586    0.4690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9552    1.6241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2931   -1.7931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9345   -0.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9586    1.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0586    2.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9414   -1.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2931   -2.5448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5414    2.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5172    3.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5931   -1.7931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586   -2.9172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3207    2.8069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5931   -2.5448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  5 12  2  0  0  0  0
  7 13  1  0  0  0  0
  8 14  2  0  0  0  0
 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
 13 17  2  0  0  0  0
 13 18  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 18 22  1  0  0  0  0
 19 23  2  0  0  0  0
 21 24  1  0  0  0  0
  6  9  1  0  0  0  0
 14 17  1  0  0  0  0
 20 23  1  0  0  0  0
M  END
>  <Mol_ID> (1,997)
1997

>  <Formula> (1,997)
C17H19NO4S2

>  <MolWeight> (1,997)
365.46706

>  <PCAT_CMPD_ID> (1,997)
WAY-308820

>  <CNC_ID> (1,997)
359421673

>  <transfer_container_id> (1,997)
PTN000000074

>  <COMPOUND_NUMBER> (1,997)
WAY-308820

>  <BAR_CODE_NO> (1,997)
3912814

>  <LOCATION_CODE> (1,997)
PTNCS

>  <AMOUNT_CURRENT> (1,997)
33.7

$$$$
WAY-308841-A
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
   -0.7276   -0.4000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.0724   -0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1276   -1.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1276    0.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7897    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8966   -1.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8966    0.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5241   -0.3690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7621    0.8483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2966   -0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2241    0.0483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4724    1.2828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2241    0.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
  7 10  2  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (1,998)
1998

>  <Formula> (1,998)
C11H20N2

>  <MolWeight> (1,998)
180.2899

>  <PCAT_CMPD_ID> (1,998)
WAY-308841-A

>  <CNC_ID> (1,998)
359421694

>  <transfer_container_id> (1,998)
PTN000000074

>  <COMPOUND_NUMBER> (1,998)
WAY-308841-A

>  <BAR_CODE_NO> (1,998)
3912837

>  <LOCATION_CODE> (1,998)
PTNCS

>  <AMOUNT_CURRENT> (1,998)
33.6

$$$$
WAY-308843
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
   -0.5690   -0.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2448   -0.2207    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9828    0.4931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9828   -0.9414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0724   -0.2276    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2552    0.6069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2448   -1.0448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8069    0.4931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8034   -0.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4931    0.4862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2207   -0.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3103    0.4862    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -3.0552   -0.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7966    1.1483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7966   -0.1828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4655    0.4931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4655   -0.9448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.9069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.0724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
  9 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (1,999)
1999

>  <Formula> (1,999)
C12H15NO5S

>  <MolWeight> (1,999)
285.3162

>  <PCAT_CMPD_ID> (1,999)
WAY-308843

>  <CNC_ID> (1,999)
359421696

>  <transfer_container_id> (1,999)
PTN000000074

>  <COMPOUND_NUMBER> (1,999)
WAY-308843

>  <BAR_CODE_NO> (1,999)
3912840

>  <LOCATION_CODE> (1,999)
PTNCS

>  <AMOUNT_CURRENT> (1,999)
33.8

$$$$
WAY-308873
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -2.2243    0.4753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8657   -0.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3657    0.2753    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3243    1.3132    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6450   -0.9868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6864    0.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9243    1.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0036   -0.5454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5243    1.6925    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2864   -1.5868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3036   -0.5247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0450    1.0339    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1036   -1.3454    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3964    0.2753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2757    0.2753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7136   -0.4868    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7136    1.0339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5964   -0.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343    0.2753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343   -1.2454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9136    0.2753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9136   -1.2454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3550   -0.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3550    1.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
  7  9  2  0  0  0  0
 11 13  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,000)
2000

>  <Formula> (2,000)
C17H17N5OS

>  <MolWeight> (2,000)
339.41478

>  <PCAT_CMPD_ID> (2,000)
WAY-308873

>  <CNC_ID> (2,000)
359421726

>  <transfer_container_id> (2,000)
PTN000000074

>  <COMPOUND_NUMBER> (2,000)
WAY-308873

>  <BAR_CODE_NO> (2,000)
3912880

>  <LOCATION_CODE> (2,000)
PTNCS

>  <AMOUNT_CURRENT> (2,000)
33.3

$$$$
WAY-308879
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
   -1.4450    0.8793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4450    0.0448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0036    0.8759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1623    1.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7243   -0.3724    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1588   -0.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0036    0.0448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8726    0.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8726    0.0483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7067   -0.3655    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5899   -0.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4205    0.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1377   -0.3586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4170    0.8759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8895   -0.0172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2274   -1.1793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4446   -0.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343   -1.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,001)
2001

>  <Formula> (2,001)
C13H10N2O2S

>  <MolWeight> (2,001)
258.2957

>  <PCAT_CMPD_ID> (2,001)
WAY-308879

>  <CNC_ID> (2,001)
359421732

>  <transfer_container_id> (2,001)
PTN000000074

>  <COMPOUND_NUMBER> (2,001)
WAY-308879

>  <BAR_CODE_NO> (2,001)
3912886

>  <LOCATION_CODE> (2,001)
PTNCS

>  <AMOUNT_CURRENT> (2,001)
33.4

$$$$
WAY-308944
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    0.3771   -0.1737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0339    0.4053    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0339   -0.7887    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7479   -0.5847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7479    0.1983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4079   -0.9567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3031   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1481   -0.1287    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3789   -0.5847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7189   -0.9567    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0619   -0.5847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6571   -0.0867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6871   -1.3648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4089    0.1623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4079    0.5703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5321   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0619    0.1983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2761    0.5703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0359   -0.9567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6331    1.2303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5321    0.5313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2491    1.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1481    1.1463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5021    1.8033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 16  1  0  0  0  0
  8  1  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  6  2  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14  9  2  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 15 17  2  0  0  0  0
 18 12  1  0  0  0  0
 19  9  1  0  0  0  0
 20 18  1  0  0  0  0
 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
 24 22  1  0  0  0  0
  4  5  2  0  0  0  0
 11 17  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,002)
2002

>  <Formula> (2,002)
C17H21N3O2S2

>  <MolWeight> (2,002)
363.49754

>  <PCAT_CMPD_ID> (2,002)
WAY-308944

>  <CNC_ID> (2,002)
359421797

>  <transfer_container_id> (2,002)
PTN000000074

>  <COMPOUND_NUMBER> (2,002)
WAY-308944

>  <BAR_CODE_NO> (2,002)
3912966

>  <LOCATION_CODE> (2,002)
PTNCS

>  <AMOUNT_CURRENT> (2,002)
33.7

$$$$
WAY-308945
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    2.3000    0.3345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9793    1.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5793   -0.2345    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.2276    0.1966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0414    1.1621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5793    1.9345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8207    0.2448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8621    0.9138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5207    1.7966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0517   -0.1379    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8138    0.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9862   -0.1379    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0379   -0.5862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5586    0.4552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1517   -1.0172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7862   -0.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1379   -1.5034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6724   -0.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9793   -1.9034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7586   -1.3552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6069   -1.6966    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  2  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 20 21  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,003)
2003

>  <Formula> (2,003)
C14H11ClN2O2S2

>  <MolWeight> (2,003)
338.83234

>  <PCAT_CMPD_ID> (2,003)
WAY-308945

>  <CNC_ID> (2,003)
359421798

>  <transfer_container_id> (2,003)
PTN000000074

>  <COMPOUND_NUMBER> (2,003)
WAY-308945

>  <BAR_CODE_NO> (2,003)
3912967

>  <LOCATION_CODE> (2,003)
PTNCS

>  <AMOUNT_CURRENT> (2,003)
33.3

$$$$
WAY-309036
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.5207   -0.8759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3207   -1.3379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4621    0.0448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3207   -1.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3207   -2.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1207   -0.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4379    0.2621    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.9207   -0.4966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5379   -2.1172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1207   -2.7172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9207   -1.3379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8000    1.1241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9207   -2.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7379    1.2241    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2379    1.8621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7207   -2.7379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    2.1621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7379    2.9034    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.2000    3.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  7  8  1  0  0  0  0
 11 13  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,004)
2004

>  <Formula> (2,004)
C15H15N3O2S

>  <MolWeight> (2,004)
301.3635

>  <PCAT_CMPD_ID> (2,004)
WAY-309036

>  <CNC_ID> (2,004)
359421889

>  <transfer_container_id> (2,004)
PTN000000074

>  <COMPOUND_NUMBER> (2,004)
WAY-309036

>  <BAR_CODE_NO> (2,004)
3913073

>  <LOCATION_CODE> (2,004)
PTNCS

>  <AMOUNT_CURRENT> (2,004)
33.5

$$$$
WAY-309048
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -2.7345    0.9379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0828    0.6069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3414    0.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7724    1.6655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4690    1.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0448   -0.1241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3069   -0.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9931    0.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4207    1.9966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8207    0.6724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6586   -0.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0345    1.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7828   -0.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2034    1.0690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4966   -0.3690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9345   -0.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9000   -1.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5621    0.0483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.4172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5138   -1.7345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2000   -0.3172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2069   -1.0483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9276   -2.1034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2517   -2.1586    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  8 12  2  0  0  0  0
 10 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
 24 27  1  0  0  0  0
 24 28  2  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 16 17  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,005)
2005

>  <Formula> (2,005)
C23H23N3O2

>  <MolWeight> (2,005)
373.44762

>  <PCAT_CMPD_ID> (2,005)
WAY-309048

>  <CNC_ID> (2,005)
359421901

>  <transfer_container_id> (2,005)
PTN000000074

>  <COMPOUND_NUMBER> (2,005)
WAY-309048

>  <BAR_CODE_NO> (2,005)
3913090

>  <LOCATION_CODE> (2,005)
PTNCS

>  <AMOUNT_CURRENT> (2,005)
33.6

$$$$
WAY-309060
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    0.9343    0.9383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4550    0.9383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1550    2.2418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1895   -0.3686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2239   -0.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3864    2.2418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8929    3.5832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9550   -1.7065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4550   -1.6686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7274   -0.2651    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7140    1.3004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1998   -2.9720    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5274   -1.4996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7312   -0.2755    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2209    1.7832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4343   -4.2755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2209   -0.7099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1278    0.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7485    0.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
 18 19  1  0  0  0  0
  8  9  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,006)
2006

>  <Formula> (2,006)
C13H14N2O4

>  <MolWeight> (2,006)
262.26126

>  <PCAT_CMPD_ID> (2,006)
WAY-309060

>  <CNC_ID> (2,006)
359421913

>  <transfer_container_id> (2,006)
PTN000000074

>  <COMPOUND_NUMBER> (2,006)
WAY-309060

>  <BAR_CODE_NO> (2,006)
3913103

>  <LOCATION_CODE> (2,006)
PTNCS

>  <AMOUNT_CURRENT> (2,006)
33.6

$$$$
WAY-309065-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -0.2276    0.8310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9448    0.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2241    1.6586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4862    0.4172    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9483   -0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6621    0.8379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4966    2.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9310    2.0690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4862   -0.4138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2310   -0.8276    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6621   -0.8207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3759    0.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5069    2.8862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9241    2.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1966   -0.8345    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3759   -0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2069    3.3069    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1931   -1.6621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1966    4.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9103   -2.0724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4724   -2.0690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8966   -2.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4655   -2.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1828   -3.3172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6138   -3.3276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  2  0  0  0  0
 20 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
  9 10  2  0  0  0  0
 12 16  2  0  0  0  0
 14 17  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,007)
2007

>  <Formula> (2,007)
C19H21N5O

>  <MolWeight> (2,007)
335.40294

>  <PCAT_CMPD_ID> (2,007)
WAY-309065-A

>  <CNC_ID> (2,007)
359421918

>  <transfer_container_id> (2,007)
PTN000000074

>  <COMPOUND_NUMBER> (2,007)
WAY-309065-A

>  <BAR_CODE_NO> (2,007)
3913108

>  <LOCATION_CODE> (2,007)
PTNCS

>  <AMOUNT_CURRENT> (2,007)
33.2

$$$$
WAY-309068
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   -1.9828    0.0138    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.4828   -1.2655    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.6103    0.2034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8207    1.0862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8310   -1.4552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8690   -2.4759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2483   -0.8655    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1103    1.4655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1828    0.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0621   -2.7966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8828   -3.4483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6103   -0.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0241    1.9724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6897   -0.3552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1172    0.6241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4690   -1.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4793    0.8345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8379   -1.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3379   -0.2345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9793    2.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4897    3.3931    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.2690    1.6138    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.6966    2.6241    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 10 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,008)
2008

>  <Formula> (2,008)
C15H16F3NO4

>  <MolWeight> (2,008)
331.2870496

>  <PCAT_CMPD_ID> (2,008)
WAY-309068

>  <CNC_ID> (2,008)
359421921

>  <transfer_container_id> (2,008)
PTN000000074

>  <COMPOUND_NUMBER> (2,008)
WAY-309068

>  <BAR_CODE_NO> (2,008)
3913111

>  <LOCATION_CODE> (2,008)
PTNCS

>  <AMOUNT_CURRENT> (2,008)
33.3

$$$$
WAY-309083
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.4690    0.5793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6310    0.8966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4690   -0.2448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793    1.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2172    0.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3690    1.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6931   -0.4966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793   -0.6448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9172    0.5793    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793    1.8276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5690   -0.0345    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4448    1.8207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9172   -0.2448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793   -1.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9828   -0.7448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9793    1.1966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6414   -0.6448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8069   -0.7448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2207   -0.0345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2207   -1.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0414   -0.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0448   -1.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4586   -0.7448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2828   -0.7448    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 13 17  2  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5  7  2  0  0  0  0
  9 13  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,009)
2009

>  <Formula> (2,009)
C16H15FN4O2S

>  <MolWeight> (2,009)
346.3793032

>  <PCAT_CMPD_ID> (2,009)
WAY-309083

>  <CNC_ID> (2,009)
359421935

>  <transfer_container_id> (2,009)
PTN000000074

>  <COMPOUND_NUMBER> (2,009)
WAY-309083

>  <BAR_CODE_NO> (2,009)
3913129

>  <LOCATION_CODE> (2,009)
PTNCS

>  <AMOUNT_CURRENT> (2,009)
33.2

$$$$
WAY-309094
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    1.1310   -0.6724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7931   -0.0724    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.3724   -0.2207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1310   -1.5414    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4310    0.7414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5724    0.6483    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8517    1.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3897   -1.5414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3931    2.2690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3897   -0.6724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8103    3.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1483   -0.2207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
  5  6  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,010)
2010

>  <Formula> (2,010)
C13H15N3O2S

>  <MolWeight> (2,010)
277.3421

>  <PCAT_CMPD_ID> (2,010)
WAY-309094

>  <CNC_ID> (2,010)
359421946

>  <transfer_container_id> (2,010)
PTN000000074

>  <COMPOUND_NUMBER> (2,010)
WAY-309094

>  <BAR_CODE_NO> (2,010)
3913142

>  <LOCATION_CODE> (2,010)
PTNCS

>  <AMOUNT_CURRENT> (2,010)
33.2

$$$$
WAY-309133-A
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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    4.2483    1.6379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,011)
2011

>  <Formula> (2,011)
C19H23N3O2

>  <MolWeight> (2,011)
325.40482

>  <PCAT_CMPD_ID> (2,011)
WAY-309133-A

>  <CNC_ID> (2,011)
359421985

>  <transfer_container_id> (2,011)
PRL000000080

>  <COMPOUND_NUMBER> (2,011)
WAY-309133-A

>  <BAR_CODE_NO> (2,011)
3943190

>  <LOCATION_CODE> (2,011)
PRLCS

>  <AMOUNT_CURRENT> (2,011)
33.3

$$$$
WAY-309144
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
   -0.0069    0.3034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3517   -0.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5069    0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1103    0.8448    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    0.8931   -0.0966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4690   -0.4552    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9690    0.4034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2966    1.1448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8483   -0.8345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7310    1.5655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0517    0.6655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1897   -1.4966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7276   -1.3345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
  5  7  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,012)
2012

>  <Formula> (2,012)
C11H15NO4

>  <MolWeight> (2,012)
225.2411

>  <PCAT_CMPD_ID> (2,012)
WAY-309144

>  <CNC_ID> (2,012)
359421996

>  <transfer_container_id> (2,012)
PTN000000074

>  <COMPOUND_NUMBER> (2,012)
WAY-309144

>  <BAR_CODE_NO> (2,012)
3913203

>  <LOCATION_CODE> (2,012)
PTNCS

>  <AMOUNT_CURRENT> (2,012)
33.4

$$$$
WAY-309177-A
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
   -2.5322    0.1194    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1822    0.1194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3761    0.1986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8614   -0.2681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2072   -0.2681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8614   -1.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2072   -1.0514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5322   -1.4431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  8  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  2  0  0  0  0
 10 12  1  0  0  0  0
 11  1  2  0  0  0  0
 12  3  2  0  0  0  0
 13  4  1  0  0  0  0
 14 10  2  0  0  0  0
 15  5  2  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18 17  2  0  0  0  0
 15 18  1  0  0  0  0
  9 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,013)
2013

>  <Formula> (2,013)
C16H20N2

>  <MolWeight> (2,013)
240.3434

>  <PCAT_CMPD_ID> (2,013)
WAY-309177-A

>  <CNC_ID> (2,013)
359422029

>  <transfer_container_id> (2,013)
PTN000000074

>  <COMPOUND_NUMBER> (2,013)
WAY-309177-A

>  <BAR_CODE_NO> (2,013)
3913241

>  <LOCATION_CODE> (2,013)
PTNCS

>  <AMOUNT_CURRENT> (2,013)
33.5

$$$$
WAY-309205
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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    0.5655    3.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  2  0  0  0  0
 10 16  1  0  0  0  0
 11 17  2  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 13 20  2  0  0  0  0
 14 21  2  0  0  0  0
 14 22  1  0  0  0  0
 15 23  1  0  0  0  0
 19 24  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  2  0  0  0  0
 24 29  1  0  0  0  0
 25 30  1  0  0  0  0
 27 31  2  0  0  0  0
 29 32  1  0  0  0  0
 32 33  1  0  0  0  0
  8 13  1  0  0  0  0
 12 16  2  0  0  0  0
 23 26  2  0  0  0  0
 28 31  1  0  0  0  0
 30 32  1  0  0  0  0
M  END
>  <Mol_ID> (2,014)
2014

>  <Formula> (2,014)
C25H23N5O3

>  <MolWeight> (2,014)
441.48182

>  <PCAT_CMPD_ID> (2,014)
WAY-309205

>  <CNC_ID> (2,014)
359422057

>  <transfer_container_id> (2,014)
PTN000000074

>  <COMPOUND_NUMBER> (2,014)
WAY-309205

>  <BAR_CODE_NO> (2,014)
3913277

>  <LOCATION_CODE> (2,014)
PTNCS

>  <AMOUNT_CURRENT> (2,014)
33.6

$$$$
WAY-309229-A
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.7172   -0.5897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0069   -0.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7138   -1.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  9 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 15  2  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,015)
2015

>  <Formula> (2,015)
C14H13N3OS

>  <MolWeight> (2,015)
271.33752

>  <PCAT_CMPD_ID> (2,015)
WAY-309229-A

>  <CNC_ID> (2,015)
359422081

>  <transfer_container_id> (2,015)
PTN000000074

>  <COMPOUND_NUMBER> (2,015)
WAY-309229-A

>  <BAR_CODE_NO> (2,015)
3913308

>  <LOCATION_CODE> (2,015)
PTNCS

>  <AMOUNT_CURRENT> (2,015)
33.3

$$$$
WAY-309236-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 13 15  1  0  0  0  0
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 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  2  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  2  0  0  0  0
 19 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
  7 10  2  0  0  0  0
  9 12  2  0  0  0  0
 20 21  2  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,016)
2016

>  <Formula> (2,016)
C19H16N4O2

>  <MolWeight> (2,016)
332.35594

>  <PCAT_CMPD_ID> (2,016)
WAY-309236-A

>  <CNC_ID> (2,016)
359422088

>  <transfer_container_id> (2,016)
PTN000000074

>  <COMPOUND_NUMBER> (2,016)
WAY-309236-A

>  <BAR_CODE_NO> (2,016)
3913316

>  <LOCATION_CODE> (2,016)
PTNCS

>  <AMOUNT_CURRENT> (2,016)
33.7

$$$$
WAY-309237
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  1  0  0  0  0
 16 19  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 17 22  1  0  0  0  0
 18 23  2  0  0  0  0
 19 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 29  2  0  0  0  0
  8 10  1  0  0  0  0
  9 13  2  0  0  0  0
 11 12  1  0  0  0  0
 18 21  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (2,017)
2017

>  <Formula> (2,017)
C24H21N3OS

>  <MolWeight> (2,017)
399.50804

>  <PCAT_CMPD_ID> (2,017)
WAY-309237

>  <CNC_ID> (2,017)
359422089

>  <transfer_container_id> (2,017)
PTN000000074

>  <COMPOUND_NUMBER> (2,017)
WAY-309237

>  <BAR_CODE_NO> (2,017)
3913317

>  <LOCATION_CODE> (2,017)
PTNCS

>  <AMOUNT_CURRENT> (2,017)
33.8

$$$$
WAY-309240-A
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   10.9292  -11.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9250   -7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  1  0  0  0  0
  9 12  1  0  0  0  0
 10  5  1  0  0  0  0
 11  5  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14  8  1  0  0  0  0
 15  6  2  0  0  0  0
 16 14  1  0  0  0  0
 17  9  1  0  0  0  0
 18 20  1  0  0  0  0
 19  7  2  0  0  0  0
 20 17  1  0  0  0  0
 21 16  2  0  0  0  0
 22 16  1  0  0  0  0
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
 25 21  1  0  0  0  0
 26 22  2  0  0  0  0
 27 26  1  0  0  0  0
  9 13  1  0  0  0  0
  3  6  1  0  0  0  0
 23 15  1  0  0  0  0
 27 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,018)
2018

>  <Formula> (2,018)
C21H25N5O

>  <MolWeight> (2,018)
363.4561

>  <PCAT_CMPD_ID> (2,018)
WAY-309240-A

>  <CNC_ID> (2,018)
359422092

>  <transfer_container_id> (2,018)
PTN000000074

>  <COMPOUND_NUMBER> (2,018)
WAY-309240-A

>  <BAR_CODE_NO> (2,018)
3913323

>  <LOCATION_CODE> (2,018)
PTNCS

>  <AMOUNT_CURRENT> (2,018)
33.6

$$$$
WAY-309263
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 15 18  2  0  0  0  0
 15 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 20 23  1  0  0  0  0
 22 24  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,019)
2019

>  <Formula> (2,019)
C14H11Cl2F3N4O

>  <MolWeight> (2,019)
379.1645496

>  <PCAT_CMPD_ID> (2,019)
WAY-309263

>  <CNC_ID> (2,019)
359422115

>  <transfer_container_id> (2,019)
PTN000000074

>  <COMPOUND_NUMBER> (2,019)
WAY-309263

>  <BAR_CODE_NO> (2,019)
3913354

>  <LOCATION_CODE> (2,019)
PTNCS

>  <AMOUNT_CURRENT> (2,019)
33.6

$$$$
WAY-309278
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
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 10 14  1  0  0  0  0
 11 10  1  0  0  0  0
 12 10  2  0  0  0  0
 13  1  1  0  0  0  0
 14  9  1  0  0  0  0
 15 11  1  0  0  0  0
 16 19  1  0  0  0  0
 17 15  2  0  0  0  0
 18 15  1  0  0  0  0
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 22 13  1  0  0  0  0
  5  3  1  0  0  0  0
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 20 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,020)
2020

>  <Formula> (2,020)
C16H20N4OS

>  <MolWeight> (2,020)
316.4212

>  <PCAT_CMPD_ID> (2,020)
WAY-309278

>  <CNC_ID> (2,020)
359422130

>  <transfer_container_id> (2,020)
PTN000000074

>  <COMPOUND_NUMBER> (2,020)
WAY-309278

>  <BAR_CODE_NO> (2,020)
3913371

>  <LOCATION_CODE> (2,020)
PTNCS

>  <AMOUNT_CURRENT> (2,020)
33.7

$$$$
WAY-309280
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  5  2  1  0  0  0  0
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 10  8  2  0  0  0  0
  9  7  2  0  0  0  0
 10  6  1  0  0  0  0
 11  6  2  0  0  0  0
 12  7  1  0  0  0  0
 13 16  2  0  0  0  0
 14  9  1  0  0  0  0
 15  9  1  0  0  0  0
 16 11  1  0  0  0  0
 12 17  2  0  0  0  0
 18 17  1  0  0  0  0
  4  5  1  0  0  0  0
  8 13  1  0  0  0  0
 18 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,021)
2021

>  <Formula> (2,021)
C14H11N3O

>  <MolWeight> (2,021)
237.25664

>  <PCAT_CMPD_ID> (2,021)
WAY-309280

>  <CNC_ID> (2,021)
359422132

>  <transfer_container_id> (2,021)
PTN000000074

>  <COMPOUND_NUMBER> (2,021)
WAY-309280

>  <BAR_CODE_NO> (2,021)
3913375

>  <LOCATION_CODE> (2,021)
PTNCS

>  <AMOUNT_CURRENT> (2,021)
33.4

$$$$
WAY-309322
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 12  2  0  0  0  0
 10 20  1  0  0  0  0
 11 10  1  0  0  0  0
 12 13  1  0  0  0  0
 13 11  1  0  0  0  0
 14 10  2  0  0  0  0
 15  6  1  0  0  0  0
 16  6  1  0  0  0  0
 17  6  1  0  0  0  0
 18  7  2  0  0  0  0
 19  7  1  0  0  0  0
 20  8  1  0  0  0  0
 21 23  1  0  0  0  0
 22 18  1  0  0  0  0
 23 19  2  0  0  0  0
 24  5  1  0  0  0  0
 25 21  1  0  0  0  0
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 27 28  1  0  0  0  0
 28 13  2  0  0  0  0
 29 25  1  0  0  0  0
  4  3  1  0  0  0  0
 21 22  2  0  0  0  0
  9 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,022)
2022

>  <Formula> (2,022)
C19H17F3N4O2S

>  <MolWeight> (2,022)
422.4240896

>  <PCAT_CMPD_ID> (2,022)
WAY-309322

>  <CNC_ID> (2,022)
359422174

>  <transfer_container_id> (2,022)
PTN000000074

>  <COMPOUND_NUMBER> (2,022)
WAY-309322

>  <BAR_CODE_NO> (2,022)
3913423

>  <LOCATION_CODE> (2,022)
PTNCS

>  <AMOUNT_CURRENT> (2,022)
33.6

$$$$
WAY-309325
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 21 24  1  0  0  0  0
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 13 15  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,023)
2023

>  <Formula> (2,023)
C18H15N3O2S

>  <MolWeight> (2,023)
337.3956

>  <PCAT_CMPD_ID> (2,023)
WAY-309325

>  <CNC_ID> (2,023)
359422177

>  <transfer_container_id> (2,023)
PTN000000074

>  <COMPOUND_NUMBER> (2,023)
WAY-309325

>  <BAR_CODE_NO> (2,023)
3913426

>  <LOCATION_CODE> (2,023)
PTNCS

>  <AMOUNT_CURRENT> (2,023)
33.3

$$$$
WAY-309383
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
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 13  6  2  0  0  0  0
 15 14  2  0  0  0  0
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  3  4  1  0  0  0  0
 13 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,024)
2024

>  <Formula> (2,024)
C10H8N2O3

>  <MolWeight> (2,024)
204.18212

>  <PCAT_CMPD_ID> (2,024)
WAY-309383

>  <CNC_ID> (2,024)
359422235

>  <transfer_container_id> (2,024)
PTN000000074

>  <COMPOUND_NUMBER> (2,024)
WAY-309383

>  <BAR_CODE_NO> (2,024)
3913487

>  <LOCATION_CODE> (2,024)
PTNCS

>  <AMOUNT_CURRENT> (2,024)
33.5

$$$$
WAY-309395
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,025)
2025

>  <Formula> (2,025)
C16H15N5OS

>  <MolWeight> (2,025)
325.3882

>  <PCAT_CMPD_ID> (2,025)
WAY-309395

>  <CNC_ID> (2,025)
359422247

>  <transfer_container_id> (2,025)
PTN000000074

>  <COMPOUND_NUMBER> (2,025)
WAY-309395

>  <BAR_CODE_NO> (2,025)
3913500

>  <LOCATION_CODE> (2,025)
PTNCS

>  <AMOUNT_CURRENT> (2,025)
33.5

$$$$
WAY-309445
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  7 10  1  0  0  0  0
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 10 14  2  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5  8  1  0  0  0  0
 15 17  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,026)
2026

>  <Formula> (2,026)
C18H16N2O2S2

>  <MolWeight> (2,026)
356.46184

>  <PCAT_CMPD_ID> (2,026)
WAY-309445

>  <CNC_ID> (2,026)
359422297

>  <transfer_container_id> (2,026)
PTN000000074

>  <COMPOUND_NUMBER> (2,026)
WAY-309445

>  <BAR_CODE_NO> (2,026)
3913557

>  <LOCATION_CODE> (2,026)
PTNCS

>  <AMOUNT_CURRENT> (2,026)
33.9

$$$$
WAY-309469
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  9  1  1  0  0  0  0
 10  8  1  0  0  0  0
 11  3  2  0  0  0  0
 12  8  2  0  0  0  0
 13 10  1  0  0  0  0
 14  2  1  0  0  0  0
 15  7  2  0  0  0  0
 16 12  1  0  0  0  0
 17  9  1  0  0  0  0
 18 24  2  0  0  0  0
 19  4  1  0  0  0  0
 20 18  1  0  0  0  0
 21  5  1  0  0  0  0
 22 17  1  0  0  0  0
 23 17  2  0  0  0  0
 24 23  1  0  0  0  0
 25 22  2  0  0  0  0
 26 27  1  0  0  0  0
 27 21  2  0  0  0  0
  2  4  1  0  0  0  0
 25 18  1  0  0  0  0
 19 26  2  0  0  0  0
 13 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,027)
2027

>  <Formula> (2,027)
C21H16ClNO3S

>  <MolWeight> (2,027)
397.87464

>  <PCAT_CMPD_ID> (2,027)
WAY-309469

>  <CNC_ID> (2,027)
359422321

>  <transfer_container_id> (2,027)
PTN000000074

>  <COMPOUND_NUMBER> (2,027)
WAY-309469

>  <BAR_CODE_NO> (2,027)
3913584

>  <LOCATION_CODE> (2,027)
PTNCS

>  <AMOUNT_CURRENT> (2,027)
33.6

$$$$
WAY-309491
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 13 16  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
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  5  9  1  0  0  0  0
 14 16  2  0  0  0  0
 19 20  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,028)
2028

>  <Formula> (2,028)
C18H13N3O2S

>  <MolWeight> (2,028)
335.37972

>  <PCAT_CMPD_ID> (2,028)
WAY-309491

>  <CNC_ID> (2,028)
359422343

>  <transfer_container_id> (2,028)
PTN000000074

>  <COMPOUND_NUMBER> (2,028)
WAY-309491

>  <BAR_CODE_NO> (2,028)
3913610

>  <LOCATION_CODE> (2,028)
PTNCS

>  <AMOUNT_CURRENT> (2,028)
33.2

$$$$
WAY-309504
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 18 22  2  0  0  0  0
 22 23  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,029)
2029

>  <Formula> (2,029)
C17H19NO4S

>  <MolWeight> (2,029)
333.40206

>  <PCAT_CMPD_ID> (2,029)
WAY-309504

>  <CNC_ID> (2,029)
359422356

>  <transfer_container_id> (2,029)
PTN000000074

>  <COMPOUND_NUMBER> (2,029)
WAY-309504

>  <BAR_CODE_NO> (2,029)
3913624

>  <LOCATION_CODE> (2,029)
PTNCS

>  <AMOUNT_CURRENT> (2,029)
33.8

$$$$
WAY-309507
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
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 13  8  1  0  0  0  0
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 15  2  2  0  0  0  0
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 21 20  2  0  0  0  0
 21 18  1  0  0  0  0
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 17 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,030)
2030

>  <Formula> (2,030)
C16H15NO3S

>  <MolWeight> (2,030)
301.3602

>  <PCAT_CMPD_ID> (2,030)
WAY-309507

>  <CNC_ID> (2,030)
359422359

>  <transfer_container_id> (2,030)
PTN000000074

>  <COMPOUND_NUMBER> (2,030)
WAY-309507

>  <BAR_CODE_NO> (2,030)
3913627

>  <LOCATION_CODE> (2,030)
PTNCS

>  <AMOUNT_CURRENT> (2,030)
33.6

$$$$
WAY-309534
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  7 14  1  0  0  0  0
  8 15  3  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
  7 11  1  0  0  0  0
 13 18  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,031)
2031

>  <Formula> (2,031)
C18H19N3O2S2

>  <MolWeight> (2,031)
373.49236

>  <PCAT_CMPD_ID> (2,031)
WAY-309534

>  <CNC_ID> (2,031)
359422386

>  <transfer_container_id> (2,031)
PTN000000074

>  <COMPOUND_NUMBER> (2,031)
WAY-309534

>  <BAR_CODE_NO> (2,031)
3913658

>  <LOCATION_CODE> (2,031)
PTNCS

>  <AMOUNT_CURRENT> (2,031)
33.1

$$$$
WAY-309561
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -0.3586   -0.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  5 10  2  0  0  0  0
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 10 16  1  0  0  0  0
 11 17  2  0  0  0  0
 12 18  1  0  0  0  0
 13 19  3  0  0  0  0
 14 20  1  0  0  0  0
 15 21  2  0  0  0  0
 16 22  2  0  0  0  0
 20 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
  8 12  1  0  0  0  0
  9 14  2  0  0  0  0
 17 22  1  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,032)
2032

>  <Formula> (2,032)
C20H15N3O2

>  <MolWeight> (2,032)
329.352

>  <PCAT_CMPD_ID> (2,032)
WAY-309561

>  <CNC_ID> (2,032)
359422413

>  <transfer_container_id> (2,032)
PTN000000074

>  <COMPOUND_NUMBER> (2,032)
WAY-309561

>  <BAR_CODE_NO> (2,032)
3913696

>  <LOCATION_CODE> (2,032)
PTNCS

>  <AMOUNT_CURRENT> (2,032)
33.2

$$$$
WAY-309562
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
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  6  4  2  0  0  0  0
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  8 11  1  0  0  0  0
  9  8  2  0  0  0  0
 10  5  1  0  0  0  0
 11 13  1  0  0  0  0
 12  8  1  0  0  0  0
 13 16  2  0  0  0  0
 14 10  1  0  0  0  0
 15 10  2  0  0  0  0
 16 15  1  0  0  0  0
 17 14  2  0  0  0  0
 18  4  1  0  0  0  0
 19  6  1  0  0  0  0
 20  7  1  0  0  0  0
 21 22  1  0  0  0  0
 22 18  2  0  0  0  0
  3  7  2  0  0  0  0
 17 13  1  0  0  0  0
 19 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,033)
2033

>  <Formula> (2,033)
C17H16N4O

>  <MolWeight> (2,033)
292.33514

>  <PCAT_CMPD_ID> (2,033)
WAY-309562

>  <CNC_ID> (2,033)
359422414

>  <transfer_container_id> (2,033)
PTN000000074

>  <COMPOUND_NUMBER> (2,033)
WAY-309562

>  <BAR_CODE_NO> (2,033)
3913697

>  <LOCATION_CODE> (2,033)
PTNCS

>  <AMOUNT_CURRENT> (2,033)
33.4

$$$$
WAY-309574
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  7  9  2  0  0  0  0
 11 16  1  0  0  0  0
 22 26  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,034)
2034

>  <Formula> (2,034)
C21H18ClN3O4

>  <MolWeight> (2,034)
411.83832

>  <PCAT_CMPD_ID> (2,034)
WAY-309574

>  <CNC_ID> (2,034)
359422426

>  <transfer_container_id> (2,034)
PTN000000074

>  <COMPOUND_NUMBER> (2,034)
WAY-309574

>  <BAR_CODE_NO> (2,034)
3913709

>  <LOCATION_CODE> (2,034)
PTNCS

>  <AMOUNT_CURRENT> (2,034)
33.6

$$$$
WAY-309580
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,035)
2035

>  <Formula> (2,035)
C15H17NO3

>  <MolWeight> (2,035)
259.30038

>  <PCAT_CMPD_ID> (2,035)
WAY-309580

>  <CNC_ID> (2,035)
359422432

>  <transfer_container_id> (2,035)
PTN000000074

>  <COMPOUND_NUMBER> (2,035)
WAY-309580

>  <BAR_CODE_NO> (2,035)
3913717

>  <LOCATION_CODE> (2,035)
PTNCS

>  <AMOUNT_CURRENT> (2,035)
33.9

$$$$
WAY-309605
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 20 22  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,036)
2036

>  <Formula> (2,036)
C17H22N2O3

>  <MolWeight> (2,036)
302.36818

>  <PCAT_CMPD_ID> (2,036)
WAY-309605

>  <CNC_ID> (2,036)
359422457

>  <transfer_container_id> (2,036)
PTN000000074

>  <COMPOUND_NUMBER> (2,036)
WAY-309605

>  <BAR_CODE_NO> (2,036)
3913743

>  <LOCATION_CODE> (2,036)
PTNCS

>  <AMOUNT_CURRENT> (2,036)
33.9

$$$$
WAY-309608
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 26 29  1  0  0  0  0
  7 12  1  0  0  0  0
 11 13  1  0  0  0  0
 19 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,037)
2037

>  <Formula> (2,037)
C20H20N2O6S

>  <MolWeight> (2,037)
416.4476

>  <PCAT_CMPD_ID> (2,037)
WAY-309608

>  <CNC_ID> (2,037)
359422460

>  <transfer_container_id> (2,037)
PTN000000074

>  <COMPOUND_NUMBER> (2,037)
WAY-309608

>  <BAR_CODE_NO> (2,037)
3913747

>  <LOCATION_CODE> (2,037)
PTNCS

>  <AMOUNT_CURRENT> (2,037)
33.3

$$$$
WAY-309609
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,038)
2038

>  <Formula> (2,038)
C19H16FN3O3S2

>  <MolWeight> (2,038)
417.4770432

>  <PCAT_CMPD_ID> (2,038)
WAY-309609

>  <CNC_ID> (2,038)
359422461

>  <transfer_container_id> (2,038)
PTN000000074

>  <COMPOUND_NUMBER> (2,038)
WAY-309609

>  <BAR_CODE_NO> (2,038)
3913748

>  <LOCATION_CODE> (2,038)
PTNCS

>  <AMOUNT_CURRENT> (2,038)
33.4

$$$$
WAY-309610
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,039)
2039

>  <Formula> (2,039)
C20H19N3O4S2

>  <MolWeight> (2,039)
429.51256

>  <PCAT_CMPD_ID> (2,039)
WAY-309610

>  <CNC_ID> (2,039)
359422462

>  <transfer_container_id> (2,039)
PTN000000074

>  <COMPOUND_NUMBER> (2,039)
WAY-309610

>  <BAR_CODE_NO> (2,039)
3913749

>  <LOCATION_CODE> (2,039)
PTNCS

>  <AMOUNT_CURRENT> (2,039)
33.2

$$$$
WAY-309639-A
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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    0.8448    0.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5552    0.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2690    0.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7000   -0.8034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 20 23  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,040)
2040

>  <Formula> (2,040)
C17H19N3O3

>  <MolWeight> (2,040)
313.35106

>  <PCAT_CMPD_ID> (2,040)
WAY-309639-A

>  <CNC_ID> (2,040)
359422491

>  <transfer_container_id> (2,040)
PTN000000074

>  <COMPOUND_NUMBER> (2,040)
WAY-309639-A

>  <BAR_CODE_NO> (2,040)
3913779

>  <LOCATION_CODE> (2,040)
PTNCS

>  <AMOUNT_CURRENT> (2,040)
33.4

$$$$
WAY-309640
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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   -2.7606    1.1274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,041)
2041

>  <Formula> (2,041)
C16H16N2OS

>  <MolWeight> (2,041)
284.37604

>  <PCAT_CMPD_ID> (2,041)
WAY-309640

>  <CNC_ID> (2,041)
359422492

>  <transfer_container_id> (2,041)
PTN000000074

>  <COMPOUND_NUMBER> (2,041)
WAY-309640

>  <BAR_CODE_NO> (2,041)
3913780

>  <LOCATION_CODE> (2,041)
PTNCS

>  <AMOUNT_CURRENT> (2,041)
33.2

$$$$
WAY-309643
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -1.3103   -0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6241    0.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  2  0  0  0  0
 12 16  2  0  0  0  0
 14 17  1  0  0  0  0
 14 18  1  0  0  0  0
 17 19  2  0  0  0  0
 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  1  0  0  0  0
 15 16  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,042)
2042

>  <Formula> (2,042)
C20H24N6

>  <MolWeight> (2,042)
348.44476

>  <PCAT_CMPD_ID> (2,042)
WAY-309643

>  <CNC_ID> (2,042)
359422495

>  <transfer_container_id> (2,042)
PTN000000074

>  <COMPOUND_NUMBER> (2,042)
WAY-309643

>  <BAR_CODE_NO> (2,042)
3913785

>  <LOCATION_CODE> (2,042)
PTNCS

>  <AMOUNT_CURRENT> (2,042)
33.7

$$$$
WAY-326204
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   12.6500   -7.5125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
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  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8 10  1  0  0  0  0
  9  5  1  0  0  0  0
 10  6  1  0  0  0  0
 11  7  2  0  0  0  0
 12 11  1  0  0  0  0
 13  8  2  0  0  0  0
 14  8  1  0  0  0  0
 15 14  2  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  2  0  0  0  0
 19 18  1  0  0  0  0
  3  4  1  0  0  0  0
  9 12  2  0  0  0  0
 17 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,043)
2043

>  <Formula> (2,043)
C14H11N3OS

>  <MolWeight> (2,043)
269.32164

>  <PCAT_CMPD_ID> (2,043)
WAY-326204

>  <CNC_ID> (2,043)
359423179

>  <transfer_container_id> (2,043)
PTN000000075

>  <COMPOUND_NUMBER> (2,043)
WAY-326204

>  <BAR_CODE_NO> (2,043)
2559076

>  <LOCATION_CODE> (2,043)
PTNCS

>  <AMOUNT_CURRENT> (2,043)
32.7

$$$$
WAY-328031
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
  4 11  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
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 10  2  2  0  0  0  0
 11 21  1  0  0  0  0
 12  9  1  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15  5  1  0  0  0  0
 16 15  1  0  0  0  0
 17  4  2  0  0  0  0
 18  6  1  0  0  0  0
 19 10  1  0  0  0  0
 20 12  2  0  0  0  0
 21 14  1  0  0  0  0
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 26 12  1  0  0  0  0
 11 22  1  0  0  0  0
 19 18  2  0  0  0  0
  9 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,044)
2044

>  <Formula> (2,044)
C18H20N2O4S2

>  <MolWeight> (2,044)
392.4924

>  <PCAT_CMPD_ID> (2,044)
WAY-328031

>  <CNC_ID> (2,044)
359424989

>  <transfer_container_id> (2,044)
PTN000000076

>  <COMPOUND_NUMBER> (2,044)
WAY-328031

>  <BAR_CODE_NO> (2,044)
2570615

>  <LOCATION_CODE> (2,044)
PTNCS

>  <AMOUNT_CURRENT> (2,044)
33

$$$$
WAY-340034
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 12  1  1  0  0  0  0
 13  4  2  0  0  0  0
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 30 31  2  0  0  0  0
 23 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,045)
2045

>  <Formula> (2,045)
C24H23N3O2S2

>  <MolWeight> (2,045)
449.58832

>  <PCAT_CMPD_ID> (2,045)
WAY-340034

>  <CNC_ID> (2,045)
359425251

>  <transfer_container_id> (2,045)
PTN000000074

>  <COMPOUND_NUMBER> (2,045)
WAY-340034

>  <BAR_CODE_NO> (2,045)
2550503

>  <LOCATION_CODE> (2,045)
PTNCS

>  <AMOUNT_CURRENT> (2,045)
32.2

$$$$
WAY-340046
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
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  5 10  1  0  0  0  0
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 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
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 13 18  1  0  0  0  0
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 15 20  1  0  0  0  0
 18 21  2  0  0  0  0
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  9 14  1  0  0  0  0
 15 17  1  0  0  0  0
 22 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,046)
2046

>  <Formula> (2,046)
C20H16N6

>  <MolWeight> (2,046)
340.38124

>  <PCAT_CMPD_ID> (2,046)
WAY-340046

>  <CNC_ID> (2,046)
359425263

>  <transfer_container_id> (2,046)
PTN000000074

>  <COMPOUND_NUMBER> (2,046)
WAY-340046

>  <BAR_CODE_NO> (2,046)
2550827

>  <LOCATION_CODE> (2,046)
PTNCS

>  <AMOUNT_CURRENT> (2,046)
32.5

$$$$
WAY-340203
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  6  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  4  1  0  0  0  0
  9  8  2  0  0  0  0
 10  3  2  0  0  0  0
 11  7  2  0  0  0  0
 12 17  1  0  0  0  0
 13 12  2  0  0  0  0
 14  7  1  0  0  0  0
 15  2  1  0  0  0  0
 16  9  1  0  0  0  0
 17 14  1  0  0  0  0
 18 16  1  0  0  0  0
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 21 18  2  0  0  0  0
 22 20  2  0  0  0  0
  5  3  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,047)
2047

>  <Formula> (2,047)
C17H18N2O3

>  <MolWeight> (2,047)
298.33642

>  <PCAT_CMPD_ID> (2,047)
WAY-340203

>  <CNC_ID> (2,047)
359425338

>  <transfer_container_id> (2,047)
PTN000000074

>  <COMPOUND_NUMBER> (2,047)
WAY-340203

>  <BAR_CODE_NO> (2,047)
2550967

>  <LOCATION_CODE> (2,047)
PTNCS

>  <AMOUNT_CURRENT> (2,047)
32.5

$$$$
WAY-340213
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12 13  1  0  0  0  0
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 14  8  1  0  0  0  0
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 16 10  1  0  0  0  0
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 20 17  1  0  0  0  0
 12  7  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,048)
2048

>  <Formula> (2,048)
C15H21NO3S

>  <MolWeight> (2,048)
295.39714

>  <PCAT_CMPD_ID> (2,048)
WAY-340213

>  <CNC_ID> (2,048)
359425348

>  <transfer_container_id> (2,048)
PTN000000074

>  <COMPOUND_NUMBER> (2,048)
WAY-340213

>  <BAR_CODE_NO> (2,048)
2550977

>  <LOCATION_CODE> (2,048)
PTNCS

>  <AMOUNT_CURRENT> (2,048)
32.8

$$$$
WAY-340665
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -0.6336   -1.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 20  2  0  0  0  0
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 12 14  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,049)
2049

>  <Formula> (2,049)
C16H18N2OS

>  <MolWeight> (2,049)
286.39192

>  <PCAT_CMPD_ID> (2,049)
WAY-340665

>  <CNC_ID> (2,049)
359425674

>  <transfer_container_id> (2,049)
PTN000000074

>  <COMPOUND_NUMBER> (2,049)
WAY-340665

>  <BAR_CODE_NO> (2,049)
2550762

>  <LOCATION_CODE> (2,049)
PTNCS

>  <AMOUNT_CURRENT> (2,049)
32.7

$$$$
WAY-340682
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  3  2  0  0  0  0
 11 23  1  0  0  0  0
 12 10  1  0  0  0  0
 13 20  2  0  0  0  0
 14 27  1  0  0  0  0
 15 26  1  0  0  0  0
 16 14  1  0  0  0  0
 17  7  1  0  0  0  0
 18  6  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  1  0  0  0  0
 21 17  1  0  0  0  0
 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
 24  6  2  0  0  0  0
 25 14  2  0  0  0  0
 26 28  2  0  0  0  0
 27 18  1  0  0  0  0
 28 20  1  0  0  0  0
 29  3  1  0  0  0  0
 30 31  1  0  0  0  0
 31 29  2  0  0  0  0
 32 23  1  0  0  0  0
 33 22  1  0  0  0  0
 22 11  1  0  0  0  0
 12 30  2  0  0  0  0
 15  7  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,050)
2050

>  <Formula> (2,050)
C22H24N2O8S

>  <MolWeight> (2,050)
476.49956

>  <PCAT_CMPD_ID> (2,050)
WAY-340682

>  <CNC_ID> (2,050)
359425691

>  <transfer_container_id> (2,050)
PTN000000074

>  <COMPOUND_NUMBER> (2,050)
WAY-340682

>  <BAR_CODE_NO> (2,050)
2550665

>  <LOCATION_CODE> (2,050)
PTNCS

>  <AMOUNT_CURRENT> (2,050)
32.6

$$$$
WAY-340694
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
   -4.3458   -5.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0042  -12.4125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.5667  -12.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.5375   -3.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.4417  -14.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6000   -7.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0500   -5.6125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6833   -7.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -9.0875    2.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 16  1  0  0  0  0
  4 15  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  4  1  0  0  0  0
  8  2  1  0  0  0  0
  9  1  2  0  0  0  0
 10  3  2  0  0  0  0
 11 10  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17 13  2  0  0  0  0
 18 14  1  0  0  0  0
 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 19 17  1  0  0  0  0
 11  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,051)
2051

>  <Formula> (2,051)
C15H15NO3S

>  <MolWeight> (2,051)
289.3495

>  <PCAT_CMPD_ID> (2,051)
WAY-340694

>  <CNC_ID> (2,051)
359425702

>  <transfer_container_id> (2,051)
PTN000000074

>  <COMPOUND_NUMBER> (2,051)
WAY-340694

>  <BAR_CODE_NO> (2,051)
2550676

>  <LOCATION_CODE> (2,051)
PTNCS

>  <AMOUNT_CURRENT> (2,051)
32.8

$$$$
WAY-340702
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.3500   -3.4042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -7.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9 10  1  0  0  0  0
 10  6  2  0  0  0  0
 11  7  2  0  0  0  0
 12  7  1  0  0  0  0
 13 14  1  0  0  0  0
 14 17  1  0  0  0  0
 15  8  1  0  0  0  0
 16 12  1  0  0  0  0
 17 16  1  0  0  0  0
 18 13  1  0  0  0  0
 19 13  2  0  0  0  0
 20 19  1  0  0  0  0
 21 18  2  0  0  0  0
 22 20  2  0  0  0  0
  4  5  1  0  0  0  0
  8  9  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,052)
2052

>  <Formula> (2,052)
C15H14N4O3

>  <MolWeight> (2,052)
298.29666

>  <PCAT_CMPD_ID> (2,052)
WAY-340702

>  <CNC_ID> (2,052)
359425710

>  <transfer_container_id> (2,052)
PTN000000074

>  <COMPOUND_NUMBER> (2,052)
WAY-340702

>  <BAR_CODE_NO> (2,052)
2550729

>  <LOCATION_CODE> (2,052)
PTNCS

>  <AMOUNT_CURRENT> (2,052)
32.9

$$$$
WAY-340772
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    5.9375   -4.8625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4667   -2.3417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.9125   -8.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9 13  1  0  0  0  0
 10  3  1  0  0  0  0
 11  3  2  0  0  0  0
 12  4  1  0  0  0  0
 13 17  2  0  0  0  0
 14 16  1  0  0  0  0
 15 10  1  0  0  0  0
 16 18  2  0  0  0  0
 17 15  1  0  0  0  0
 18 17  1  0  0  0  0
 19 12  1  0  0  0  0
 20  4  2  0  0  0  0
 21  9  2  0  0  0  0
 22 12  2  0  0  0  0
 23 14  2  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 26 24  2  0  0  0  0
 27 23  1  0  0  0  0
  8  2  1  0  0  0  0
 22 26  1  0  0  0  0
 14  9  1  0  0  0  0
 27 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,053)
2053

>  <Formula> (2,053)
C22H22N2O3

>  <MolWeight> (2,053)
362.42168

>  <PCAT_CMPD_ID> (2,053)
WAY-340772

>  <CNC_ID> (2,053)
359425776

>  <transfer_container_id> (2,053)
PTN000000074

>  <COMPOUND_NUMBER> (2,053)
WAY-340772

>  <BAR_CODE_NO> (2,053)
2550780

>  <LOCATION_CODE> (2,053)
PTNCS

>  <AMOUNT_CURRENT> (2,053)
32.5

$$$$
WAY-340388
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   11.1167   -4.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9042   -3.5417    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
 11  4  2  0  0  0  0
 12  7  2  0  0  0  0
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 15  8  1  0  0  0  0
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 17  3  1  0  0  0  0
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 26 25  2  0  0  0  0
 10 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,054)
2054

>  <Formula> (2,054)
C20H20N2O3S

>  <MolWeight> (2,054)
368.4494

>  <PCAT_CMPD_ID> (2,054)
WAY-340388

>  <CNC_ID> (2,054)
359425411

>  <transfer_container_id> (2,054)
PTN000000074

>  <COMPOUND_NUMBER> (2,054)
WAY-340388

>  <BAR_CODE_NO> (2,054)
2550378

>  <LOCATION_CODE> (2,054)
PTNCS

>  <AMOUNT_CURRENT> (2,054)
32

$$$$
WAY-340460
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  3  1  0  0  0  0
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  7  6  2  0  0  0  0
  8  5  1  0  0  0  0
  9  7  1  0  0  0  0
 10  8  1  0  0  0  0
 11  3  1  0  0  0  0
 12  1  1  0  0  0  0
 13  6  1  0  0  0  0
 14 15  1  0  0  0  0
 15 13  2  0  0  0  0
 16 21  1  0  0  0  0
 17  9  1  0  0  0  0
 18 10  1  0  0  0  0
 19 10  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  1  0  0  0  0
 22 11  2  0  0  0  0
 23 11  1  0  0  0  0
 24 14  1  0  0  0  0
 25 23  2  0  0  0  0
 26 22  1  0  0  0  0
 27 25  1  0  0  0  0
  4  5  2  0  0  0  0
 26 27  2  0  0  0  0
  9 14  2  0  0  0  0
 20 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,055)
2055

>  <Formula> (2,055)
C21H23ClN4O

>  <MolWeight> (2,055)
382.88652

>  <PCAT_CMPD_ID> (2,055)
WAY-340460

>  <CNC_ID> (2,055)
359425482

>  <transfer_container_id> (2,055)
PTN000000074

>  <COMPOUND_NUMBER> (2,055)
WAY-340460

>  <BAR_CODE_NO> (2,055)
2550542

>  <LOCATION_CODE> (2,055)
PTNCS

>  <AMOUNT_CURRENT> (2,055)
32.7

$$$$
WAY-340506
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
   13.2292   -7.8292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.1375    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3 12  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  8 11  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  2  0  0  0  0
 11  7  1  0  0  0  0
 12 23  1  0  0  0  0
 13  9  1  0  0  0  0
 14  1  1  0  0  0  0
 15  1  2  0  0  0  0
 16  1  2  0  0  0  0
 17 13  1  0  0  0  0
 18  4  1  0  0  0  0
 19 22  1  0  0  0  0
 20  5  1  0  0  0  0
 21 17  2  0  0  0  0
 22 20  2  0  0  0  0
 23 17  1  0  0  0  0
 24  6  2  0  0  0  0
 25  7  1  0  0  0  0
 26  8  1  0  0  0  0
 27 24  1  0  0  0  0
 28 14  1  0  0  0  0
 29 14  1  0  0  0  0
 30 19  1  0  0  0  0
 31 24  1  0  0  0  0
 19  9  2  0  0  0  0
  8  4  1  0  0  0  0
 18 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,056)
2056

>  <Formula> (2,056)
C21H21Cl2N3O4S

>  <MolWeight> (2,056)
482.38014

>  <PCAT_CMPD_ID> (2,056)
WAY-340506

>  <CNC_ID> (2,056)
359425507

>  <transfer_container_id> (2,056)
PTN000000074

>  <COMPOUND_NUMBER> (2,056)
WAY-340506

>  <BAR_CODE_NO> (2,056)
2550462

>  <LOCATION_CODE> (2,056)
PTNCS

>  <AMOUNT_CURRENT> (2,056)
32.2

$$$$
WAY-340571
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7 10  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10 17  1  0  0  0  0
 11  9  1  0  0  0  0
 12  5  1  0  0  0  0
 13  5  2  0  0  0  0
 14 10  2  0  0  0  0
 15  8  1  0  0  0  0
 16 19  1  0  0  0  0
 17 12  1  0  0  0  0
 18  9  1  0  0  0  0
 19 15  2  0  0  0  0
 20 16  1  0  0  0  0
 21  2  1  0  0  0  0
 22  6  1  0  0  0  0
  3  6  1  0  0  0  0
 11 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,057)
2057

>  <Formula> (2,057)
C15H13F2NO4

>  <MolWeight> (2,057)
309.2648264

>  <PCAT_CMPD_ID> (2,057)
WAY-340571

>  <CNC_ID> (2,057)
359425571

>  <transfer_container_id> (2,057)
PTN000000074

>  <COMPOUND_NUMBER> (2,057)
WAY-340571

>  <BAR_CODE_NO> (2,057)
2550571

>  <LOCATION_CODE> (2,057)
PTNCS

>  <AMOUNT_CURRENT> (2,057)
33

$$$$
WAY-340873
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  8  1  0  0  0  0
 14 12  2  0  0  0  0
 15  3  1  0  0  0  0
 16  2  1  0  0  0  0
 17 14  1  0  0  0  0
 18  5  1  0  0  0  0
 19 22  1  0  0  0  0
 20 12  1  0  0  0  0
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 23 19  1  0  0  0  0
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 25 24  1  0  0  0  0
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  7  9  2  0  0  0  0
 21 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,058)
2058

>  <Formula> (2,058)
C18H21FN4OS

>  <MolWeight> (2,058)
360.4489432

>  <PCAT_CMPD_ID> (2,058)
WAY-340873

>  <CNC_ID> (2,058)
359425876

>  <transfer_container_id> (2,058)
PTN000000074

>  <COMPOUND_NUMBER> (2,058)
WAY-340873

>  <BAR_CODE_NO> (2,058)
2551106

>  <LOCATION_CODE> (2,058)
PTNCS

>  <AMOUNT_CURRENT> (2,058)
32.2

$$$$
WAY-340884
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  5  1  0  0  0  0
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 14  7  2  0  0  0  0
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 20  6  2  0  0  0  0
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 23  9  2  0  0  0  0
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  4  9  1  0  0  0  0
 19 27  2  0  0  0  0
 31 23  1  0  0  0  0
 10 15  1  0  0  0  0
 32 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,059)
2059

>  <Formula> (2,059)
C25H19N3O3S

>  <MolWeight> (2,059)
441.50166

>  <PCAT_CMPD_ID> (2,059)
WAY-340884

>  <CNC_ID> (2,059)
359425886

>  <transfer_container_id> (2,059)
PTN000000074

>  <COMPOUND_NUMBER> (2,059)
WAY-340884

>  <BAR_CODE_NO> (2,059)
2550833

>  <LOCATION_CODE> (2,059)
PTNCS

>  <AMOUNT_CURRENT> (2,059)
32.9

$$$$
WAY-340916
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
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  7  1  1  0  0  0  0
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 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  5  1  0  0  0  0
 14 12  1  0  0  0  0
 15  7  1  0  0  0  0
 16 15  2  0  0  0  0
 17 11  2  0  0  0  0
 18 10  2  0  0  0  0
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 22 17  1  0  0  0  0
 14 19  2  0  0  0  0
 10 11  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,060)
2060

>  <Formula> (2,060)
C15H12ClN3O2S

>  <MolWeight> (2,060)
333.79268

>  <PCAT_CMPD_ID> (2,060)
WAY-340916

>  <CNC_ID> (2,060)
359425917

>  <transfer_container_id> (2,060)
PTN000000074

>  <COMPOUND_NUMBER> (2,060)
WAY-340916

>  <BAR_CODE_NO> (2,060)
2551013

>  <LOCATION_CODE> (2,060)
PTNCS

>  <AMOUNT_CURRENT> (2,060)
32.4

$$$$
WAY-340935
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
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 16  1  2  0  0  0  0
 17  7  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  2  0  0  0  0
 19 17  1  0  0  0  0
  5  3  1  0  0  0  0
  9 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,061)
2061

>  <Formula> (2,061)
C15H11BrN2O

>  <MolWeight> (2,061)
315.16464

>  <PCAT_CMPD_ID> (2,061)
WAY-340935

>  <CNC_ID> (2,061)
359425936

>  <transfer_container_id> (2,061)
PTN000000074

>  <COMPOUND_NUMBER> (2,061)
WAY-340935

>  <BAR_CODE_NO> (2,061)
2550903

>  <LOCATION_CODE> (2,061)
PTNCS

>  <AMOUNT_CURRENT> (2,061)
33

$$$$
WAY-340936
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 11  5  2  0  0  0  0
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 15  8  1  0  0  0  0
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 16 12  1  0  0  0  0
 22 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,062)
2062

>  <Formula> (2,062)
C16H17NO5

>  <MolWeight> (2,062)
303.30988

>  <PCAT_CMPD_ID> (2,062)
WAY-340936

>  <CNC_ID> (2,062)
359425937

>  <transfer_container_id> (2,062)
PTN000000074

>  <COMPOUND_NUMBER> (2,062)
WAY-340936

>  <BAR_CODE_NO> (2,062)
2550904

>  <LOCATION_CODE> (2,062)
PTNCS

>  <AMOUNT_CURRENT> (2,062)
32.8

$$$$
WAY-341033
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,063)
2063

>  <Formula> (2,063)
C11H14N2O3S

>  <MolWeight> (2,063)
254.30546

>  <PCAT_CMPD_ID> (2,063)
WAY-341033

>  <CNC_ID> (2,063)
359426031

>  <transfer_container_id> (2,063)
PTN000000074

>  <COMPOUND_NUMBER> (2,063)
WAY-341033

>  <BAR_CODE_NO> (2,063)
2551413

>  <LOCATION_CODE> (2,063)
PTNCS

>  <AMOUNT_CURRENT> (2,063)
32.4

$$$$
WAY-341085
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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   -4.2708   -0.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
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  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  7  2  0  0  0  0
 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
 15  8  1  0  0  0  0
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 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
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 20 10  2  0  0  0  0
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  4  5  2  0  0  0  0
 16 18  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,064)
2064

>  <Formula> (2,064)
C19H16N2O3S

>  <MolWeight> (2,064)
352.40694

>  <PCAT_CMPD_ID> (2,064)
WAY-341085

>  <CNC_ID> (2,064)
359426081

>  <transfer_container_id> (2,064)
PTN000000074

>  <COMPOUND_NUMBER> (2,064)
WAY-341085

>  <BAR_CODE_NO> (2,064)
2551196

>  <LOCATION_CODE> (2,064)
PTNCS

>  <AMOUNT_CURRENT> (2,064)
32.7

$$$$
WAY-341094
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.6686   -1.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 11 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,065)
2065

>  <Formula> (2,065)
C14H13N3O2S

>  <MolWeight> (2,065)
287.33692

>  <PCAT_CMPD_ID> (2,065)
WAY-341094

>  <CNC_ID> (2,065)
359426089

>  <transfer_container_id> (2,065)
PTN000000074

>  <COMPOUND_NUMBER> (2,065)
WAY-341094

>  <BAR_CODE_NO> (2,065)
2551116

>  <LOCATION_CODE> (2,065)
PTNCS

>  <AMOUNT_CURRENT> (2,065)
32.3

$$$$
WAY-341178
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.8762    0.1106    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
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  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
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  5 10  2  0  0  0  0
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  9 13  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7  9  1  0  0  0  0
 11 14  2  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,066)
2066

>  <Formula> (2,066)
C16H13NO3S

>  <MolWeight> (2,066)
299.34432

>  <PCAT_CMPD_ID> (2,066)
WAY-341178

>  <CNC_ID> (2,066)
359426171

>  <transfer_container_id> (2,066)
PTN000000074

>  <COMPOUND_NUMBER> (2,066)
WAY-341178

>  <BAR_CODE_NO> (2,066)
2551246

>  <LOCATION_CODE> (2,066)
PTNCS

>  <AMOUNT_CURRENT> (2,066)
26.8

$$$$
WAY-341263
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   11.9042   -9.7917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8792   -9.7917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  1  0  0  0  0
 11  5  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  7  2  0  0  0  0
 15 10  2  0  0  0  0
 16 10  1  0  0  0  0
 17 18  1  0  0  0  0
 18 16  2  0  0  0  0
 19 15  1  0  0  0  0
 20 17  1  0  0  0  0
 21  4  1  0  0  0  0
 22  9  2  0  0  0  0
 23 11  2  0  0  0  0
 24 22  1  0  0  0  0
 25 23  1  0  0  0  0
 19 17  2  0  0  0  0
  9 11  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,067)
2067

>  <Formula> (2,067)
C16H14ClN3O3S2

>  <MolWeight> (2,067)
395.88366

>  <PCAT_CMPD_ID> (2,067)
WAY-341263

>  <CNC_ID> (2,067)
359426254

>  <transfer_container_id> (2,067)
PTN000000074

>  <COMPOUND_NUMBER> (2,067)
WAY-341263

>  <BAR_CODE_NO> (2,067)
2551292

>  <LOCATION_CODE> (2,067)
PTNCS

>  <AMOUNT_CURRENT> (2,067)
32.5

$$$$
WAY-341375
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
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 18  7  1  0  0  0  0
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 26  9  1  0  0  0  0
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 29 10  1  0  0  0  0
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 25 20  2  0  0  0  0
  6  2  2  0  0  0  0
 31 17  1  0  0  0  0
 33 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,068)
2068

>  <Formula> (2,068)
C24H24FN3O5S

>  <MolWeight> (2,068)
485.5278632

>  <PCAT_CMPD_ID> (2,068)
WAY-341375

>  <CNC_ID> (2,068)
359426365

>  <transfer_container_id> (2,068)
PTN000000074

>  <COMPOUND_NUMBER> (2,068)
WAY-341375

>  <BAR_CODE_NO> (2,068)
2551987

>  <LOCATION_CODE> (2,068)
PTNCS

>  <AMOUNT_CURRENT> (2,068)
33

$$$$
WAY-341444
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 15  6  2  0  0  0  0
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 21 24  1  0  0  0  0
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 25 22  1  0  0  0  0
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 27 13  1  0  0  0  0
 28 26  1  0  0  0  0
 21 25  2  0  0  0  0
 12 20  2  0  0  0  0
 14 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,069)
2069

>  <Formula> (2,069)
C20H20N2O4S2

>  <MolWeight> (2,069)
416.5138

>  <PCAT_CMPD_ID> (2,069)
WAY-341444

>  <CNC_ID> (2,069)
359426410

>  <transfer_container_id> (2,069)
PTN000000074

>  <COMPOUND_NUMBER> (2,069)
WAY-341444

>  <BAR_CODE_NO> (2,069)
2551378

>  <LOCATION_CODE> (2,069)
PTNCS

>  <AMOUNT_CURRENT> (2,069)
32.1

$$$$
WAY-341494
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  2  1  0  0  0  0
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  6  7  2  0  0  0  0
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  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12 14  1  0  0  0  0
 13  5  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  1  0  0  0  0
 16  5  2  0  0  0  0
 17  7  1  0  0  0  0
 18 21  1  0  0  0  0
 19  6  1  0  0  0  0
 20 15  1  0  0  0  0
 21 17  2  0  0  0  0
 22 18  1  0  0  0  0
 23  3  1  0  0  0  0
 24  4  2  0  0  0  0
 25 23  2  0  0  0  0
 26 25  1  0  0  0  0
 27 15  2  0  0  0  0
 28 24  1  0  0  0  0
 29 28  2  0  0  0  0
 26 14  2  0  0  0  0
 27 29  1  0  0  0  0
 18 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,070)
2070

>  <Formula> (2,070)
C20H15Cl2FN2O3S

>  <MolWeight> (2,070)
453.3141032

>  <PCAT_CMPD_ID> (2,070)
WAY-341494

>  <CNC_ID> (2,070)
359426457

>  <transfer_container_id> (2,070)
PTN000000074

>  <COMPOUND_NUMBER> (2,070)
WAY-341494

>  <BAR_CODE_NO> (2,070)
2551436

>  <LOCATION_CODE> (2,070)
PTNCS

>  <AMOUNT_CURRENT> (2,070)
29.6

$$$$
WAY-341557
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
   12.4167   -8.7750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8667   -7.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  6  1  0  0  0  0
  5  3  1  0  0  0  0
  6 11  1  0  0  0  0
  7  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  9  2  0  0  0  0
 12  7  1  0  0  0  0
 13  8  1  0  0  0  0
 14  5  1  0  0  0  0
 15  5  1  0  0  0  0
 16  6  2  0  0  0  0
 17  4  2  0  0  0  0
 18  7  1  0  0  0  0
 19 12  1  0  0  0  0
 20 12  1  0  0  0  0
 21 16  1  0  0  0  0
 22 21  2  0  0  0  0
 23 18  1  0  0  0  0
 24 23  1  0  0  0  0
 24 20  1  0  0  0  0
 17 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,071)
2071

>  <Formula> (2,071)
C17H22F2N2O3

>  <MolWeight> (2,071)
340.3649864

>  <PCAT_CMPD_ID> (2,071)
WAY-341557

>  <CNC_ID> (2,071)
359426516

>  <transfer_container_id> (2,071)
PTN000000074

>  <COMPOUND_NUMBER> (2,071)
WAY-341557

>  <BAR_CODE_NO> (2,071)
2551502

>  <LOCATION_CODE> (2,071)
PTNCS

>  <AMOUNT_CURRENT> (2,071)
32.7

$$$$
WAY-341563
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  4  2  0  0  0  0
 12  5  2  0  0  0  0
 13  7  2  0  0  0  0
 14  7  1  0  0  0  0
 15  8  2  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18 12  1  0  0  0  0
 19 14  2  0  0  0  0
 20 15  1  0  0  0  0
 21 16  2  0  0  0  0
 22 13  1  0  0  0  0
 23 19  1  0  0  0  0
 24 21  1  0  0  0  0
  4  5  1  0  0  0  0
 22 23  2  0  0  0  0
 17 18  2  0  0  0  0
 20 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,072)
2072

>  <Formula> (2,072)
C22H20N2

>  <MolWeight> (2,072)
312.4076

>  <PCAT_CMPD_ID> (2,072)
WAY-341563

>  <CNC_ID> (2,072)
359426522

>  <transfer_container_id> (2,072)
PTN000000074

>  <COMPOUND_NUMBER> (2,072)
WAY-341563

>  <BAR_CODE_NO> (2,072)
2551487

>  <LOCATION_CODE> (2,072)
PTNCS

>  <AMOUNT_CURRENT> (2,072)
30.3

$$$$
WAY-341569
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  2  1  0  0  0  0
 12  3  1  0  0  0  0
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 18  7  1  0  0  0  0
 19  9  2  0  0  0  0
 20  8  2  0  0  0  0
 21 22  2  0  0  0  0
 22 13  1  0  0  0  0
 23 21  1  0  0  0  0
 24 17  1  0  0  0  0
 25 18  1  0  0  0  0
 26 27  2  0  0  0  0
 27 20  1  0  0  0  0
  7 11  1  0  0  0  0
  5  9  1  0  0  0  0
 26 19  1  0  0  0  0
 17 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,073)
2073

>  <Formula> (2,073)
C23H22N2O2

>  <MolWeight> (2,073)
358.43298

>  <PCAT_CMPD_ID> (2,073)
WAY-341569

>  <CNC_ID> (2,073)
359426527

>  <transfer_container_id> (2,073)
PTN000000074

>  <COMPOUND_NUMBER> (2,073)
WAY-341569

>  <BAR_CODE_NO> (2,073)
2551515

>  <LOCATION_CODE> (2,073)
PTNCS

>  <AMOUNT_CURRENT> (2,073)
32.8

$$$$
WAY-341610
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
   12.6167   -7.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  5  2  1  0  0  0  0
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  9  3  2  0  0  0  0
 10  4  2  0  0  0  0
 11 18  1  0  0  0  0
 12 19  2  0  0  0  0
 13  5  1  0  0  0  0
 14  8  2  0  0  0  0
 15  7  1  0  0  0  0
 16 14  1  0  0  0  0
 17  3  1  0  0  0  0
 18 16  2  0  0  0  0
 19 16  1  0  0  0  0
 20  2  1  0  0  0  0
 21 20  1  0  0  0  0
 22  5  1  0  0  0  0
 23 21  1  0  0  0  0
 24 13  1  0  0  0  0
 25 17  1  0  0  0  0
 23 13  1  0  0  0  0
  6 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,074)
2074

>  <Formula> (2,074)
C19H26N2O4

>  <MolWeight> (2,074)
346.42074

>  <PCAT_CMPD_ID> (2,074)
WAY-341610

>  <CNC_ID> (2,074)
359426567

>  <transfer_container_id> (2,074)
PTN000000074

>  <COMPOUND_NUMBER> (2,074)
WAY-341610

>  <BAR_CODE_NO> (2,074)
2551601

>  <LOCATION_CODE> (2,074)
PTNCS

>  <AMOUNT_CURRENT> (2,074)
28.9

$$$$
WAY-341701
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
    5.9750   -3.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  2  0  0  0  0
  7 18  1  0  0  0  0
  8  7  1  0  0  0  0
  9  1  1  0  0  0  0
 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
 12  4  1  0  0  0  0
 13  2  1  0  0  0  0
 14  9  1  0  0  0  0
 15 14  1  0  0  0  0
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 20 13  2  0  0  0  0
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 22 21  2  0  0  0  0
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 25 10  2  0  0  0  0
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 27 24  1  0  0  0  0
 28 25  1  0  0  0  0
 29 26  1  0  0  0  0
  5  3  1  0  0  0  0
 17 19  2  0  0  0  0
 23 24  2  0  0  0  0
 10 11  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,075)
2075

>  <Formula> (2,075)
C22H19N5OS

>  <MolWeight> (2,075)
401.48416

>  <PCAT_CMPD_ID> (2,075)
WAY-341701

>  <CNC_ID> (2,075)
359426651

>  <transfer_container_id> (2,075)
PTN000000074

>  <COMPOUND_NUMBER> (2,075)
WAY-341701

>  <BAR_CODE_NO> (2,075)
2551818

>  <LOCATION_CODE> (2,075)
PTNCS

>  <AMOUNT_CURRENT> (2,075)
32.4

$$$$
WAY-341811
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   11.4792   -9.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
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 10  3  1  0  0  0  0
 11 12  1  0  0  0  0
 12  4  1  0  0  0  0
 13  7  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  2  0  0  0  0
 16 15  1  0  0  0  0
 17  1  1  0  0  0  0
 18  3  1  0  0  0  0
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 20 10  2  0  0  0  0
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 22 13  2  0  0  0  0
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 27 21  2  0  0  0  0
 28 27  1  0  0  0  0
 25 18  2  0  0  0  0
 28 26  2  0  0  0  0
 23 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,076)
2076

>  <Formula> (2,076)
C23H18FNO3

>  <MolWeight> (2,076)
375.3923232

>  <PCAT_CMPD_ID> (2,076)
WAY-341811

>  <CNC_ID> (2,076)
359426754

>  <transfer_container_id> (2,076)
PTN000000074

>  <COMPOUND_NUMBER> (2,076)
WAY-341811

>  <BAR_CODE_NO> (2,076)
2551807

>  <LOCATION_CODE> (2,076)
PTNCS

>  <AMOUNT_CURRENT> (2,076)
32.8

$$$$
WAY-341845
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11 13  1  0  0  0  0
 12  7  1  0  0  0  0
 13  4  1  0  0  0  0
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 20  1  1  0  0  0  0
 21  3  1  0  0  0  0
 22 10  2  0  0  0  0
 23 10  1  0  0  0  0
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 25 24  1  0  0  0  0
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 25 21  2  0  0  0  0
 28 26  2  0  0  0  0
 14 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,077)
2077

>  <Formula> (2,077)
C23H18ClNO3

>  <MolWeight> (2,077)
391.84692

>  <PCAT_CMPD_ID> (2,077)
WAY-341845

>  <CNC_ID> (2,077)
359426786

>  <transfer_container_id> (2,077)
PTN000000074

>  <COMPOUND_NUMBER> (2,077)
WAY-341845

>  <BAR_CODE_NO> (2,077)
2551896

>  <LOCATION_CODE> (2,077)
PTNCS

>  <AMOUNT_CURRENT> (2,077)
32.4

$$$$
WAY-342194
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
 12  8  2  0  0  0  0
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 15  6  1  0  0  0  0
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 13  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,078)
2078

>  <Formula> (2,078)
C16H24N2O

>  <MolWeight> (2,078)
260.37456

>  <PCAT_CMPD_ID> (2,078)
WAY-342194

>  <CNC_ID> (2,078)
359427113

>  <transfer_container_id> (2,078)
PTN000000074

>  <COMPOUND_NUMBER> (2,078)
WAY-342194

>  <BAR_CODE_NO> (2,078)
2552355

>  <LOCATION_CODE> (2,078)
PTNCS

>  <AMOUNT_CURRENT> (2,078)
32.7

$$$$
WAY-342197
csChFnd80/10111816222D

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 10  3  1  0  0  0  0
 11  1  1  0  0  0  0
 12  3  2  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 15 10  1  0  0  0  0
 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
 18 22  1  0  0  0  0
 19 15  2  0  0  0  0
 20 15  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  2  0  0  0  0
 23 18  1  0  0  0  0
 24 17  1  0  0  0  0
 25 16  1  0  0  0  0
  2  4  2  0  0  0  0
  6  7  1  0  0  0  0
 21 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,079)
2079

>  <Formula> (2,079)
C20H24N2O3

>  <MolWeight> (2,079)
340.41616

>  <PCAT_CMPD_ID> (2,079)
WAY-342197

>  <CNC_ID> (2,079)
359427116

>  <transfer_container_id> (2,079)
PTN000000074

>  <COMPOUND_NUMBER> (2,079)
WAY-342197

>  <BAR_CODE_NO> (2,079)
2552362

>  <LOCATION_CODE> (2,079)
PTNCS

>  <AMOUNT_CURRENT> (2,079)
32.5

$$$$
WAY-342235
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11  1  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  2  0  0  0  0
 14  9  1  0  0  0  0
 15 13  1  0  0  0  0
 16  8  2  0  0  0  0
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 18 10  1  0  0  0  0
 19  9  2  0  0  0  0
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  4  5  1  0  0  0  0
 20 14  1  0  0  0  0
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 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,080)
2080

>  <Formula> (2,080)
C20H17ClN4S

>  <MolWeight> (2,080)
380.89378

>  <PCAT_CMPD_ID> (2,080)
WAY-342235

>  <CNC_ID> (2,080)
359427150

>  <transfer_container_id> (2,080)
PTN000000074

>  <COMPOUND_NUMBER> (2,080)
WAY-342235

>  <BAR_CODE_NO> (2,080)
2552291

>  <LOCATION_CODE> (2,080)
PTNCS

>  <AMOUNT_CURRENT> (2,080)
32.5

$$$$
WL-109943
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 14 17  1  0  0  0  0
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 13 16  2  0  0  0  0
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M  END
>  <Mol_ID> (2,081)
2081

>  <Formula> (2,081)
C14H11N3

>  <MolWeight> (2,081)
221.25724

>  <PCAT_CMPD_ID> (2,081)
WL-109943

>  <CNC_ID> (2,081)
359433493

>  <transfer_container_id> (2,081)
PTN000000074

>  <COMPOUND_NUMBER> (2,081)
WL-109943

>  <BAR_CODE_NO> (2,081)
3913715

>  <LOCATION_CODE> (2,081)
PTNCS

>  <AMOUNT_CURRENT> (2,081)
33.1

$$$$
WL-152815
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 11 16  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,082)
2082

>  <Formula> (2,082)
C19H14N2S

>  <MolWeight> (2,082)
302.39286

>  <PCAT_CMPD_ID> (2,082)
WL-152815

>  <CNC_ID> (2,082)
359433496

>  <transfer_container_id> (2,082)
PTN000000074

>  <COMPOUND_NUMBER> (2,082)
WL-152815

>  <BAR_CODE_NO> (2,082)
3913338

>  <LOCATION_CODE> (2,082)
PTNCS

>  <AMOUNT_CURRENT> (2,082)
33.7

$$$$
WAY-345620
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 25  8  1  0  0  0  0
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 19 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,083)
2083

>  <Formula> (2,083)
C17H21Cl2N3O5S

>  <MolWeight> (2,083)
450.33674

>  <PCAT_CMPD_ID> (2,083)
WAY-345620

>  <CNC_ID> (2,083)
359433565

>  <transfer_container_id> (2,083)
PTN000000075

>  <COMPOUND_NUMBER> (2,083)
WAY-345620

>  <BAR_CODE_NO> (2,083)
2555994

>  <LOCATION_CODE> (2,083)
PTNCS

>  <AMOUNT_CURRENT> (2,083)
32.4

$$$$
WAY-345669
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 15  6  2  0  0  0  0
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 22  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,084)
2084

>  <Formula> (2,084)
C25H20N2O4

>  <MolWeight> (2,084)
412.4373

>  <PCAT_CMPD_ID> (2,084)
WAY-345669

>  <CNC_ID> (2,084)
359433602

>  <transfer_container_id> (2,084)
PTN000000075

>  <COMPOUND_NUMBER> (2,084)
WAY-345669

>  <BAR_CODE_NO> (2,084)
2555873

>  <LOCATION_CODE> (2,084)
PTNCS

>  <AMOUNT_CURRENT> (2,084)
33

$$$$
WAY-345686
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
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 13  9  1  0  0  0  0
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 22  3  1  0  0  0  0
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 31 30  1  0  0  0  0
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M  END
>  <Mol_ID> (2,085)
2085

>  <Formula> (2,085)
C24H23NO6

>  <MolWeight> (2,085)
421.44252

>  <PCAT_CMPD_ID> (2,085)
WAY-345686

>  <CNC_ID> (2,085)
359433619

>  <transfer_container_id> (2,085)
PTN000000075

>  <COMPOUND_NUMBER> (2,085)
WAY-345686

>  <BAR_CODE_NO> (2,085)
2555913

>  <LOCATION_CODE> (2,085)
PTNCS

>  <AMOUNT_CURRENT> (2,085)
11.8

$$$$
WAY-345694
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 11  9  2  0  0  0  0
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 12 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,086)
2086

>  <Formula> (2,086)
C18H15Cl2N3O4S

>  <MolWeight> (2,086)
440.3004

>  <PCAT_CMPD_ID> (2,086)
WAY-345694

>  <CNC_ID> (2,086)
359433626

>  <transfer_container_id> (2,086)
PTN000000075

>  <COMPOUND_NUMBER> (2,086)
WAY-345694

>  <BAR_CODE_NO> (2,086)
2555921

>  <LOCATION_CODE> (2,086)
PTNCS

>  <AMOUNT_CURRENT> (2,086)
32.4

$$$$
WAY-345696
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
 13  7  1  0  0  0  0
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 18  5  1  0  0  0  0
 19  6  1  0  0  0  0
 20 11  1  0  0  0  0
  6  4  1  0  0  0  0
 12  9  2  0  0  0  0
 15  8  1  0  0  0  0
M  END
>  <Mol_ID> (2,087)
2087

>  <Formula> (2,087)
C14H18N4OS

>  <MolWeight> (2,087)
290.38392

>  <PCAT_CMPD_ID> (2,087)
WAY-345696

>  <CNC_ID> (2,087)
359433628

>  <transfer_container_id> (2,087)
PTN000000075

>  <COMPOUND_NUMBER> (2,087)
WAY-345696

>  <BAR_CODE_NO> (2,087)
2555923

>  <LOCATION_CODE> (2,087)
PTNCS

>  <AMOUNT_CURRENT> (2,087)
32.6

$$$$
WAY-345874
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
 13 12  2  0  0  0  0
 14  5  1  0  0  0  0
 15  8  2  0  0  0  0
 16  9  2  0  0  0  0
 17 11  1  0  0  0  0
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 19  4  1  0  0  0  0
 20  7  1  0  0  0  0
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  7  3  1  0  0  0  0
 29 28  1  0  0  0  0
 21 25  2  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,088)
2088

>  <Formula> (2,088)
C23H21N3O2S

>  <MolWeight> (2,088)
403.49674

>  <PCAT_CMPD_ID> (2,088)
WAY-345874

>  <CNC_ID> (2,088)
359433796

>  <transfer_container_id> (2,088)
PTN000000075

>  <COMPOUND_NUMBER> (2,088)
WAY-345874

>  <BAR_CODE_NO> (2,088)
2556540

>  <LOCATION_CODE> (2,088)
PTNCS

>  <AMOUNT_CURRENT> (2,088)
32.7

$$$$
WAY-345896
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
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 14  3  2  0  0  0  0
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 17  8  2  0  0  0  0
 18  8  1  0  0  0  0
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 29 23  1  0  0  0  0
  2  4  1  0  0  0  0
 12  9  1  0  0  0  0
 15 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,089)
2089

>  <Formula> (2,089)
C22H27N3O4

>  <MolWeight> (2,089)
397.46748

>  <PCAT_CMPD_ID> (2,089)
WAY-345896

>  <CNC_ID> (2,089)
359433810

>  <transfer_container_id> (2,089)
PTN000000075

>  <COMPOUND_NUMBER> (2,089)
WAY-345896

>  <BAR_CODE_NO> (2,089)
2556929

>  <LOCATION_CODE> (2,089)
PTNCS

>  <AMOUNT_CURRENT> (2,089)
32.2

$$$$
WAY-345932
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11 12  1  0  0  0  0
 12  9  1  0  0  0  0
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  9  5  2  0  0  0  0
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 26 16  2  0  0  0  0
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M  END
>  <Mol_ID> (2,090)
2090

>  <Formula> (2,090)
C22H26N4O2S

>  <MolWeight> (2,090)
410.53244

>  <PCAT_CMPD_ID> (2,090)
WAY-345932

>  <CNC_ID> (2,090)
359433837

>  <transfer_container_id> (2,090)
PTN000000075

>  <COMPOUND_NUMBER> (2,090)
WAY-345932

>  <BAR_CODE_NO> (2,090)
2556324

>  <LOCATION_CODE> (2,090)
PTNCS

>  <AMOUNT_CURRENT> (2,090)
29.7

$$$$
WAY-345941
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,091)
2091

>  <Formula> (2,091)
C10H6O3S

>  <MolWeight> (2,091)
206.21784

>  <PCAT_CMPD_ID> (2,091)
WAY-345941

>  <CNC_ID> (2,091)
359433845

>  <transfer_container_id> (2,091)
PTN000000075

>  <COMPOUND_NUMBER> (2,091)
WAY-345941

>  <BAR_CODE_NO> (2,091)
2556335

>  <LOCATION_CODE> (2,091)
PTNCS

>  <AMOUNT_CURRENT> (2,091)
32.8

$$$$
WAY-345945
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  5  4  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9 17  1  0  0  0  0
 10  2  1  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13 14  1  0  0  0  0
 14 11  2  0  0  0  0
 15 22  1  0  0  0  0
 16 12  1  0  0  0  0
 17 16  1  0  0  0  0
 18  9  1  0  0  0  0
 19  9  1  0  0  0  0
 20  8  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
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 28 26  1  0  0  0  0
  5  3  1  0  0  0  0
 13  8  2  0  0  0  0
 28 27  2  0  0  0  0
 15 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,092)
2092

>  <Formula> (2,092)
C22H26N4OS

>  <MolWeight> (2,092)
394.53304

>  <PCAT_CMPD_ID> (2,092)
WAY-345945

>  <CNC_ID> (2,092)
359433849

>  <transfer_container_id> (2,092)
PTN000000075

>  <COMPOUND_NUMBER> (2,092)
WAY-345945

>  <BAR_CODE_NO> (2,092)
2556186

>  <LOCATION_CODE> (2,092)
PTNCS

>  <AMOUNT_CURRENT> (2,092)
32.1

$$$$
WAY-345957
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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   13.0167  -10.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2917  -12.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
  7  2  2  0  0  0  0
  8  5  2  0  0  0  0
  9  3  1  0  0  0  0
 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 10  1  0  0  0  0
 16 12  2  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19 14  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22 17  2  0  0  0  0
 22 16  1  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,093)
2093

>  <Formula> (2,093)
C18H26N2O2

>  <MolWeight> (2,093)
302.41124

>  <PCAT_CMPD_ID> (2,093)
WAY-345957

>  <CNC_ID> (2,093)
359433860

>  <transfer_container_id> (2,093)
PTN000000075

>  <COMPOUND_NUMBER> (2,093)
WAY-345957

>  <BAR_CODE_NO> (2,093)
2556139

>  <LOCATION_CODE> (2,093)
PTNCS

>  <AMOUNT_CURRENT> (2,093)
32.1

$$$$
WAY-345995
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6 10  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
  7 10  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,094)
2094

>  <Formula> (2,094)
C14H19ClN2O

>  <MolWeight> (2,094)
266.76646

>  <PCAT_CMPD_ID> (2,094)
WAY-345995

>  <CNC_ID> (2,094)
359433895

>  <transfer_container_id> (2,094)
PTN000000075

>  <COMPOUND_NUMBER> (2,094)
WAY-345995

>  <BAR_CODE_NO> (2,094)
2556374

>  <LOCATION_CODE> (2,094)
PTNCS

>  <AMOUNT_CURRENT> (2,094)
32.7

$$$$
WAY-346000
csChFnd80/10111816222D

 31 33  0  0  0  0  0  0  0  0999 V2000
   14.1167   -1.7375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.3917   -2.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  2  0  0  0  0
  8  1  2  0  0  0  0
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 10 13  1  0  0  0  0
 11  2  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  4  2  0  0  0  0
 15  5  2  0  0  0  0
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 20 15  1  0  0  0  0
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 22  5  1  0  0  0  0
 23 12  1  0  0  0  0
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 26 20  1  0  0  0  0
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 29 23  2  0  0  0  0
 30 28  1  0  0  0  0
 31 29  1  0  0  0  0
 18 13  2  0  0  0  0
 24 30  2  0  0  0  0
 25 31  2  0  0  0  0
M  END
>  <Mol_ID> (2,095)
2095

>  <Formula> (2,095)
C21H20ClN3O5S

>  <MolWeight> (2,095)
461.9186

>  <PCAT_CMPD_ID> (2,095)
WAY-346000

>  <CNC_ID> (2,095)
359433900

>  <transfer_container_id> (2,095)
PTN000000075

>  <COMPOUND_NUMBER> (2,095)
WAY-346000

>  <BAR_CODE_NO> (2,095)
2556379

>  <LOCATION_CODE> (2,095)
PTNCS

>  <AMOUNT_CURRENT> (2,095)
32.4

$$$$
WAY-346034
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  4  1  0  0  0  0
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  3  6  1  0  0  0  0
  9  7  1  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,096)
2096

>  <Formula> (2,096)
C14H13N3S

>  <MolWeight> (2,096)
255.33812

>  <PCAT_CMPD_ID> (2,096)
WAY-346034

>  <CNC_ID> (2,096)
359433933

>  <transfer_container_id> (2,096)
PTN000000075

>  <COMPOUND_NUMBER> (2,096)
WAY-346034

>  <BAR_CODE_NO> (2,096)
2556215

>  <LOCATION_CODE> (2,096)
PTNCS

>  <AMOUNT_CURRENT> (2,096)
33

$$$$
WAY-346130
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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    6.7167  -10.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6417   -8.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5167  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  5  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  2  0  0  0  0
 13  4  2  0  0  0  0
 14  3  1  0  0  0  0
 15  9  2  0  0  0  0
 16 15  1  0  0  0  0
 17  8  2  0  0  0  0
 18  9  1  0  0  0  0
 19 17  1  0  0  0  0
 20 11  2  0  0  0  0
 21 10  2  0  0  0  0
 22 19  2  0  0  0  0
 23 14  2  0  0  0  0
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 25 21  1  0  0  0  0
 26 25  2  0  0  0  0
 27 24  2  0  0  0  0
 28 23  1  0  0  0  0
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 11  7  1  0  0  0  0
 20 26  1  0  0  0  0
 29 28  2  0  0  0  0
 22 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,097)
2097

>  <Formula> (2,097)
C24H21ClN2O2

>  <MolWeight> (2,097)
404.88874

>  <PCAT_CMPD_ID> (2,097)
WAY-346130

>  <CNC_ID> (2,097)
359434024

>  <transfer_container_id> (2,097)
PTN000000075

>  <COMPOUND_NUMBER> (2,097)
WAY-346130

>  <BAR_CODE_NO> (2,097)
2556289

>  <LOCATION_CODE> (2,097)
PTNCS

>  <AMOUNT_CURRENT> (2,097)
32.3

$$$$
WAY-346176
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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    6.2167   -2.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  2  0  0  0  0
  9  7  1  0  0  0  0
 10  3  2  0  0  0  0
 11  5  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  1  0  0  0  0
 14 11  1  0  0  0  0
 15 13  1  0  0  0  0
 16 13  2  0  0  0  0
 17 14  2  0  0  0  0
 18 14  1  0  0  0  0
 19 15  2  0  0  0  0
 20 18  2  0  0  0  0
 21 17  1  0  0  0  0
 22 16  1  0  0  0  0
 23 22  2  0  0  0  0
 24 20  1  0  0  0  0
  5  4  1  0  0  0  0
 23 19  1  0  0  0  0
 24 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,098)
2098

>  <Formula> (2,098)
C18H17N3O3

>  <MolWeight> (2,098)
323.34588

>  <PCAT_CMPD_ID> (2,098)
WAY-346176

>  <CNC_ID> (2,098)
359434069

>  <transfer_container_id> (2,098)
PTN000000075

>  <COMPOUND_NUMBER> (2,098)
WAY-346176

>  <BAR_CODE_NO> (2,098)
2556368

>  <LOCATION_CODE> (2,098)
PTNCS

>  <AMOUNT_CURRENT> (2,098)
32.4

$$$$
WAY-346193
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   14.1917   -4.8042    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4 14  1  0  0  0  0
  5  2  2  0  0  0  0
  6  3  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  2  1  0  0  0  0
 10  5  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15  1  1  0  0  0  0
 16  8  1  0  0  0  0
 17  4  2  0  0  0  0
 18  8  2  0  0  0  0
 19 21  1  0  0  0  0
 20  5  1  0  0  0  0
 21  9  2  0  0  0  0
 22 19  1  0  0  0  0
 23  7  1  0  0  0  0
 13  6  1  0  0  0  0
 10 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,099)
2099

>  <Formula> (2,099)
C14H17ClN2O5S

>  <MolWeight> (2,099)
360.81318

>  <PCAT_CMPD_ID> (2,099)
WAY-346193

>  <CNC_ID> (2,099)
359434085

>  <transfer_container_id> (2,099)
PTN000000075

>  <COMPOUND_NUMBER> (2,099)
WAY-346193

>  <BAR_CODE_NO> (2,099)
2556349

>  <LOCATION_CODE> (2,099)
PTNCS

>  <AMOUNT_CURRENT> (2,099)
32.7

$$$$
WAY-346271
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    9.4417   -6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4 11  1  0  0  0  0
  5  4  2  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10  1  1  0  0  0  0
 11 15  1  0  0  0  0
 12 14  3  0  0  0  0
 13  9  1  0  0  0  0
 14 18  1  0  0  0  0
 15 10  1  0  0  0  0
 16 11  2  0  0  0  0
 17  3  1  0  0  0  0
 18 17  1  0  0  0  0
 19  6  2  0  0  0  0
 20  9  2  0  0  0  0
 21  7  2  0  0  0  0
 22 13  2  0  0  0  0
 23 19  1  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 26 24  2  0  0  0  0
  6  7  1  0  0  0  0
 23 25  2  0  0  0  0
  8 13  1  0  0  0  0
 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,100)
2100

>  <Formula> (2,100)
C20H16N4OS

>  <MolWeight> (2,100)
360.43224

>  <PCAT_CMPD_ID> (2,100)
WAY-346271

>  <CNC_ID> (2,100)
359434160

>  <transfer_container_id> (2,100)
PTN000000075

>  <COMPOUND_NUMBER> (2,100)
WAY-346271

>  <BAR_CODE_NO> (2,100)
2556460

>  <LOCATION_CODE> (2,100)
PTNCS

>  <AMOUNT_CURRENT> (2,100)
32.4

$$$$
WAY-346279
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
   -2.0333    0.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  8  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  1  0  0  0  0
 10  1  2  0  0  0  0
 11  4  1  0  0  0  0
 12 15  1  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15 11  2  0  0  0  0
 16  7  1  0  0  0  0
 17  7  1  0  0  0  0
 18  9  1  0  0  0  0
 19  9  1  0  0  0  0
 20 13  1  0  0  0  0
 21 14  1  0  0  0  0
 22 21  1  0  0  0  0
  6 12  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,101)
2101

>  <Formula> (2,101)
C18H29N3O

>  <MolWeight> (2,101)
303.44236

>  <PCAT_CMPD_ID> (2,101)
WAY-346279

>  <CNC_ID> (2,101)
359434168

>  <transfer_container_id> (2,101)
PTN000000075

>  <COMPOUND_NUMBER> (2,101)
WAY-346279

>  <BAR_CODE_NO> (2,101)
2556721

>  <LOCATION_CODE> (2,101)
PTNCS

>  <AMOUNT_CURRENT> (2,101)
32.4

$$$$
WAY-346343
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
   14.1000   -6.8417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2500   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2000   -7.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2667    1.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6208    1.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.2667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0667   -5.7750    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -0.7500    4.8875    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 12  1  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10 11  1  0  0  0  0
 11 13  1  0  0  0  0
 12 20  1  0  0  0  0
 13  5  1  0  0  0  0
 14  1  1  0  0  0  0
 15  3  2  0  0  0  0
 16 10  2  0  0  0  0
 17 14  1  0  0  0  0
 18 21  1  0  0  0  0
 19  4  1  0  0  0  0
 20 10  1  0  0  0  0
 21  6  2  0  0  0  0
 22 18  1  0  0  0  0
 17 13  1  0  0  0  0
  7 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,102)
2102

>  <Formula> (2,102)
C13H15ClN2O5S

>  <MolWeight> (2,102)
346.7866

>  <PCAT_CMPD_ID> (2,102)
WAY-346343

>  <CNC_ID> (2,102)
359434232

>  <transfer_container_id> (2,102)
PTN000000075

>  <COMPOUND_NUMBER> (2,102)
WAY-346343

>  <BAR_CODE_NO> (2,102)
2556556

>  <LOCATION_CODE> (2,102)
PTNCS

>  <AMOUNT_CURRENT> (2,102)
32.4

$$$$
WAY-346649
csChFnd80/10111816222D

 12 13  0  0  0  0  0  0  0  0999 V2000
    0.8724   -0.2793    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0138   -1.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7931   -1.2379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4138    0.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
 10 12  1  0  0  0  0
  7  9  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,103)
2103

>  <Formula> (2,103)
C9H15N3

>  <MolWeight> (2,103)
165.2355

>  <PCAT_CMPD_ID> (2,103)
WAY-346649

>  <CNC_ID> (2,103)
359434532

>  <transfer_container_id> (2,103)
PTN000000075

>  <COMPOUND_NUMBER> (2,103)
WAY-346649

>  <BAR_CODE_NO> (2,103)
2557099

>  <LOCATION_CODE> (2,103)
PTNCS

>  <AMOUNT_CURRENT> (2,103)
32.3

$$$$
WAY-346658
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    9.4875   -6.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6375   -5.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9125   -6.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6292   -7.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9292   -8.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1125   -9.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  2  0  0  0  0
 10  6  2  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13 11  1  0  0  0  0
 14 17  1  0  0  0  0
 15 14  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 13  2  0  0  0  0
 19 13  1  0  0  0  0
  7  8  2  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,104)
2104

>  <Formula> (2,104)
C13H11ClN2O2S

>  <MolWeight> (2,104)
294.75664

>  <PCAT_CMPD_ID> (2,104)
WAY-346658

>  <CNC_ID> (2,104)
359434541

>  <transfer_container_id> (2,104)
PTN000000075

>  <COMPOUND_NUMBER> (2,104)
WAY-346658

>  <BAR_CODE_NO> (2,104)
2556822

>  <LOCATION_CODE> (2,104)
PTNCS

>  <AMOUNT_CURRENT> (2,104)
32.1

$$$$
WAY-346763
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   11.9167  -12.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  2  0  0  0  0
 11  9  1  0  0  0  0
 12  8  2  0  0  0  0
 13  2  1  0  0  0  0
 14  5  1  0  0  0  0
 15 11  1  0  0  0  0
 16  9  2  0  0  0  0
 17  8  1  0  0  0  0
 18 11  2  0  0  0  0
 19 15  1  0  0  0  0
 20 16  1  0  0  0  0
 21 20  2  0  0  0  0
  5  3  2  0  0  0  0
 18 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,105)
2105

>  <Formula> (2,105)
C16H18N2O3

>  <MolWeight> (2,105)
286.32572

>  <PCAT_CMPD_ID> (2,105)
WAY-346763

>  <CNC_ID> (2,105)
359434644

>  <transfer_container_id> (2,105)
PTN000000075

>  <COMPOUND_NUMBER> (2,105)
WAY-346763

>  <BAR_CODE_NO> (2,105)
2556986

>  <LOCATION_CODE> (2,105)
PTNCS

>  <AMOUNT_CURRENT> (2,105)
32.2

$$$$
WAY-346793
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    6.3792   -5.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
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  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  4  1  0  0  0  0
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 10  6  2  0  0  0  0
 11  7  1  0  0  0  0
 12  4  2  0  0  0  0
 13  7  2  0  0  0  0
 14  9  2  0  0  0  0
 15 11  1  0  0  0  0
 16 15  1  0  0  0  0
 17 10  1  0  0  0  0
 18 25  2  0  0  0  0
 19 17  2  0  0  0  0
 20  9  1  0  0  0  0
 21 18  1  0  0  0  0
 22 16  1  0  0  0  0
 23 16  2  0  0  0  0
 24 22  2  0  0  0  0
 25 23  1  0  0  0  0
 26 17  1  0  0  0  0
  2  3  1  0  0  0  0
 14 19  1  0  0  0  0
 24 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,106)
2106

>  <Formula> (2,106)
C19H15ClN2O4

>  <MolWeight> (2,106)
370.7864

>  <PCAT_CMPD_ID> (2,106)
WAY-346793

>  <CNC_ID> (2,106)
359434674

>  <transfer_container_id> (2,106)
PTN000000075

>  <COMPOUND_NUMBER> (2,106)
WAY-346793

>  <BAR_CODE_NO> (2,106)
2557079

>  <LOCATION_CODE> (2,106)
PTNCS

>  <AMOUNT_CURRENT> (2,106)
32.2

$$$$
WAY-346862
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
   11.3417  -13.4292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10  8  3  0  0  0  0
 11  6  1  0  0  0  0
 12 11  1  0  0  0  0
 13  4  1  0  0  0  0
 14  9  1  0  0  0  0
 15 19  2  0  0  0  0
 16 15  1  0  0  0  0
 17 14  1  0  0  0  0
 18 14  2  0  0  0  0
 19 18  1  0  0  0  0
 20 17  2  0  0  0  0
 21 12  2  0  0  0  0
 22 11  2  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
  3  5  1  0  0  0  0
 15 20  1  0  0  0  0
  7 12  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,107)
2107

>  <Formula> (2,107)
C18H12ClN5

>  <MolWeight> (2,107)
333.77438

>  <PCAT_CMPD_ID> (2,107)
WAY-346862

>  <CNC_ID> (2,107)
359434741

>  <transfer_container_id> (2,107)
PTN000000075

>  <COMPOUND_NUMBER> (2,107)
WAY-346862

>  <BAR_CODE_NO> (2,107)
2557158

>  <LOCATION_CODE> (2,107)
PTNCS

>  <AMOUNT_CURRENT> (2,107)
32.5

$$$$
WAY-346874
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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   11.8042   -4.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -5.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  2  0  0  0  0
  7  4  1  0  0  0  0
  8  4  1  0  0  0  0
  9  5  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13  3  1  0  0  0  0
 14 15  2  0  0  0  0
 15  9  1  0  0  0  0
 16  8  2  0  0  0  0
 17  8  1  0  0  0  0
 18  7  2  0  0  0  0
 19  7  1  0  0  0  0
 20 14  1  0  0  0  0
 21 12  1  0  0  0  0
 22 18  1  0  0  0  0
 23 19  2  0  0  0  0
 24 16  1  0  0  0  0
 25 17  2  0  0  0  0
 26 23  1  0  0  0  0
 27 25  1  0  0  0  0
 20 11  2  0  0  0  0
 27 24  2  0  0  0  0
 26 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,108)
2108

>  <Formula> (2,108)
C24H25NO2

>  <MolWeight> (2,108)
359.4608

>  <PCAT_CMPD_ID> (2,108)
WAY-346874

>  <CNC_ID> (2,108)
359434752

>  <transfer_container_id> (2,108)
PTN000000075

>  <COMPOUND_NUMBER> (2,108)
WAY-346874

>  <BAR_CODE_NO> (2,108)
2557233

>  <LOCATION_CODE> (2,108)
PTNCS

>  <AMOUNT_CURRENT> (2,108)
32.8

$$$$
WAY-346890
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   10.2917   -5.4042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  1  0  0  0  0
  7 12  1  0  0  0  0
  8  6  1  0  0  0  0
  9  2  1  0  0  0  0
 10  4  1  0  0  0  0
 11  6  2  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14  7  2  0  0  0  0
 15 11  1  0  0  0  0
 16  9  2  0  0  0  0
 17  9  1  0  0  0  0
 18 20  1  0  0  0  0
 19 16  1  0  0  0  0
 20 17  2  0  0  0  0
 21 18  1  0  0  0  0
 22 21  1  0  0  0  0
  5  3  1  0  0  0  0
 19 18  2  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,109)
2109

>  <Formula> (2,109)
C15H12N2O3S2

>  <MolWeight> (2,109)
332.39738

>  <PCAT_CMPD_ID> (2,109)
WAY-346890

>  <CNC_ID> (2,109)
359434766

>  <transfer_container_id> (2,109)
PTN000000075

>  <COMPOUND_NUMBER> (2,109)
WAY-346890

>  <BAR_CODE_NO> (2,109)
2557108

>  <LOCATION_CODE> (2,109)
PTNCS

>  <AMOUNT_CURRENT> (2,109)
32.2

$$$$
WAY-347051
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6  8  1  0  0  0  0
  7  6  2  0  0  0  0
  8 10  1  0  0  0  0
  9  7  1  0  0  0  0
 10  2  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  1  0  0  0  0
 13  1  1  0  0  0  0
 14 15  1  0  0  0  0
 15 11  2  0  0  0  0
 16  5  1  0  0  0  0
 17 12  1  0  0  0  0
 18 12  1  0  0  0  0
 19 15  1  0  0  0  0
 20 13  1  0  0  0  0
 21 16  1  0  0  0  0
 22 20  1  0  0  0  0
  3  4  1  0  0  0  0
 21 22  1  0  0  0  0
  9 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,110)
2110

>  <Formula> (2,110)
C18H25N3O

>  <MolWeight> (2,110)
299.4106

>  <PCAT_CMPD_ID> (2,110)
WAY-347051

>  <CNC_ID> (2,110)
359434925

>  <transfer_container_id> (2,110)
PTN000000075

>  <COMPOUND_NUMBER> (2,110)
WAY-347051

>  <BAR_CODE_NO> (2,110)
2557649

>  <LOCATION_CODE> (2,110)
PTNCS

>  <AMOUNT_CURRENT> (2,110)
26.2

$$$$
WAY-347085
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    3.0292   -7.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  6  1  0  0  0  0
  5  2  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10  2  2  0  0  0  0
 11  4  2  0  0  0  0
 12 14  1  0  0  0  0
 13  6  1  0  0  0  0
 14  7  2  0  0  0  0
 15  3  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  1  0  0  0  0
 18 17  1  0  0  0  0
 19 15  1  0  0  0  0
  8 12  2  0  0  0  0
 16  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,111)
2111

>  <Formula> (2,111)
C13H14O5S

>  <MolWeight> (2,111)
282.31226

>  <PCAT_CMPD_ID> (2,111)
WAY-347085

>  <CNC_ID> (2,111)
359434956

>  <transfer_container_id> (2,111)
PTN000000075

>  <COMPOUND_NUMBER> (2,111)
WAY-347085

>  <BAR_CODE_NO> (2,111)
2557285

>  <LOCATION_CODE> (2,111)
PTNCS

>  <AMOUNT_CURRENT> (2,111)
32.7

$$$$
WAY-347087
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    8.8750   -4.5417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  7  2  0  0  0  0
 11  9  1  0  0  0  0
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 13  1  1  0  0  0  0
 14  6  1  0  0  0  0
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 16  7  1  0  0  0  0
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 22 16  2  0  0  0  0
  3  5  1  0  0  0  0
 15 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,112)
2112

>  <Formula> (2,112)
C15H21N5OS

>  <MolWeight> (2,112)
319.42514

>  <PCAT_CMPD_ID> (2,112)
WAY-347087

>  <CNC_ID> (2,112)
359434958

>  <transfer_container_id> (2,112)
PTN000000075

>  <COMPOUND_NUMBER> (2,112)
WAY-347087

>  <BAR_CODE_NO> (2,112)
2557356

>  <LOCATION_CODE> (2,112)
PTNCS

>  <AMOUNT_CURRENT> (2,112)
32.4

$$$$
WAY-347111
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.2665    2.4469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8573    2.4276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7627    3.6126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1463    3.6340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6084    2.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4165    1.7679    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4123    3.1450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0736    3.5742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0992    1.3281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4063    2.1714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  1  0  0  0  0
  9  1  2  0  0  0  0
 10  3  1  0  0  0  0
 11  1  1  0  0  0  0
 12  6  1  0  0  0  0
 13 10  1  0  0  0  0
 14  2  2  0  0  0  0
 15 12  2  0  0  0  0
 16 15  1  0  0  0  0
 17 12  1  0  0  0  0
 18  9  1  0  0  0  0
 19 11  1  0  0  0  0
 20 15  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
  7  8  1  0  0  0  0
  6 13  2  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,113)
2113

>  <Formula> (2,113)
C15H12ClN3O2S

>  <MolWeight> (2,113)
333.79268

>  <PCAT_CMPD_ID> (2,113)
WAY-347111

>  <CNC_ID> (2,113)
359434982

>  <transfer_container_id> (2,113)
PTN000000075

>  <COMPOUND_NUMBER> (2,113)
WAY-347111

>  <BAR_CODE_NO> (2,113)
2557318

>  <LOCATION_CODE> (2,113)
PTNCS

>  <AMOUNT_CURRENT> (2,113)
32.2

$$$$
WAY-347120
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
    9.1542   -7.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4292   -7.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5500   -9.8667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7292   -0.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  2  0  0  0  0
  8  5  2  0  0  0  0
  9 10  1  0  0  0  0
 10  2  2  0  0  0  0
 11  8  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  1  0  0  0  0
 14  9  2  0  0  0  0
 15  8  1  0  0  0  0
 16 13  2  0  0  0  0
 17 16  1  0  0  0  0
 14 12  1  0  0  0  0
 15 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,114)
2114

>  <Formula> (2,114)
C12H10ClN3O

>  <MolWeight> (2,114)
247.6803

>  <PCAT_CMPD_ID> (2,114)
WAY-347120

>  <CNC_ID> (2,114)
359434991

>  <transfer_container_id> (2,114)
PTN000000075

>  <COMPOUND_NUMBER> (2,114)
WAY-347120

>  <BAR_CODE_NO> (2,114)
2557327

>  <LOCATION_CODE> (2,114)
PTNCS

>  <AMOUNT_CURRENT> (2,114)
32.5

$$$$
WAY-347187
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
   12.5250   -6.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6292   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8167   -9.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.4542   -8.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.7667  -12.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  9  3  0  0  0  0
  8  3  1  0  0  0  0
  9 14  1  0  0  0  0
 10  6  1  0  0  0  0
 11  6  2  0  0  0  0
 12  8  2  0  0  0  0
 13 10  1  0  0  0  0
 14 18  1  0  0  0  0
 15  2  1  0  0  0  0
 16 13  1  0  0  0  0
 17  5  1  0  0  0  0
 18 21  2  0  0  0  0
 19 20  1  0  0  0  0
 20 16  2  0  0  0  0
 21 16  1  0  0  0  0
 22  8  1  0  0  0  0
  3  5  2  0  0  0  0
 14 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,115)
2115

>  <Formula> (2,115)
C17H16N2O3

>  <MolWeight> (2,115)
296.32054

>  <PCAT_CMPD_ID> (2,115)
WAY-347187

>  <CNC_ID> (2,115)
359435056

>  <transfer_container_id> (2,115)
PTN000000075

>  <COMPOUND_NUMBER> (2,115)
WAY-347187

>  <BAR_CODE_NO> (2,115)
2557425

>  <LOCATION_CODE> (2,115)
PTNCS

>  <AMOUNT_CURRENT> (2,115)
32.1

$$$$
WAY-347197
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    4.8788    3.4558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4053    0.9486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
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  7  2  1  0  0  0  0
  8 14  1  0  0  0  0
  9  1  2  0  0  0  0
 10  2  2  0  0  0  0
 11  6  2  0  0  0  0
 12  5  2  0  0  0  0
 13  5  1  0  0  0  0
 14 17  1  0  0  0  0
 15  4  1  0  0  0  0
 16 15  1  0  0  0  0
 17 13  2  0  0  0  0
 18 12  1  0  0  0  0
 19  6  1  0  0  0  0
 18 14  2  0  0  0  0
 16  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,116)
2116

>  <Formula> (2,116)
C13H13NO5

>  <MolWeight> (2,116)
263.24602

>  <PCAT_CMPD_ID> (2,116)
WAY-347197

>  <CNC_ID> (2,116)
359435066

>  <transfer_container_id> (2,116)
PTN000000075

>  <COMPOUND_NUMBER> (2,116)
WAY-347197

>  <BAR_CODE_NO> (2,116)
2557405

>  <LOCATION_CODE> (2,116)
PTNCS

>  <AMOUNT_CURRENT> (2,116)
32.4

$$$$
WAY-347285
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.0250   -7.7375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7417   -8.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.2292  -11.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 12  1  0  0  0  0
 11  6  1  0  0  0  0
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 13  2  1  0  0  0  0
 14  3  2  0  0  0  0
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 17  1  1  0  0  0  0
 18  7  2  0  0  0  0
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 22  5  2  0  0  0  0
 23  8  2  0  0  0  0
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 25 17  1  0  0  0  0
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  8  4  1  0  0  0  0
 23 29  1  0  0  0  0
  7  9  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,117)
2117

>  <Formula> (2,117)
C23H22N2O4S

>  <MolWeight> (2,117)
422.49678

>  <PCAT_CMPD_ID> (2,117)
WAY-347285

>  <CNC_ID> (2,117)
359435154

>  <transfer_container_id> (2,117)
PTN000000075

>  <COMPOUND_NUMBER> (2,117)
WAY-347285

>  <BAR_CODE_NO> (2,117)
2561464

>  <LOCATION_CODE> (2,117)
PTNCS

>  <AMOUNT_CURRENT> (2,117)
32.5

$$$$
WAY-347288
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
    6.5792   -7.1667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    6.6000   -8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8000  -10.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6042   -6.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6042   -6.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0292   -9.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.5417   -9.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  4  1  0  0  0  0
  9  2  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 15  1  0  0  0  0
 13  8  1  0  0  0  0
 14  8  1  0  0  0  0
 15  9  2  0  0  0  0
 16 15  1  0  0  0  0
 17 10  2  0  0  0  0
 18  3  1  0  0  0  0
 19  5  1  0  0  0  0
 20 10  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
 14 13  1  0  0  0  0
  5 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,118)
2118

>  <Formula> (2,118)
C14H17NO6S

>  <MolWeight> (2,118)
327.35288

>  <PCAT_CMPD_ID> (2,118)
WAY-347288

>  <CNC_ID> (2,118)
359435157

>  <transfer_container_id> (2,118)
PTN000000075

>  <COMPOUND_NUMBER> (2,118)
WAY-347288

>  <BAR_CODE_NO> (2,118)
2561467

>  <LOCATION_CODE> (2,118)
PTNCS

>  <AMOUNT_CURRENT> (2,118)
32.7

$$$$
WAY-347316
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   10.2042  -11.2875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5542   -5.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2875   -2.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2292  -12.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0625  -14.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2417  -15.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 15  1  0  0  0  0
  4  3  1  0  0  0  0
  5 16  1  0  0  0  0
  6  3  2  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  2  1  0  0  0  0
 13  2  1  0  0  0  0
 14  1  1  0  0  0  0
 15 18  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  1  0  0  0  0
 18  8  1  0  0  0  0
 19  8  2  0  0  0  0
 20 14  1  0  0  0  0
 21 14  2  0  0  0  0
 22 20  2  0  0  0  0
 23 21  1  0  0  0  0
 24 23  2  0  0  0  0
 17  5  1  0  0  0  0
 22 24  1  0  0  0  0
  7  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,119)
2119

>  <Formula> (2,119)
C14H17N5O3S2

>  <MolWeight> (2,119)
367.44648

>  <PCAT_CMPD_ID> (2,119)
WAY-347316

>  <CNC_ID> (2,119)
359435183

>  <transfer_container_id> (2,119)
PTN000000075

>  <COMPOUND_NUMBER> (2,119)
WAY-347316

>  <BAR_CODE_NO> (2,119)
2557465

>  <LOCATION_CODE> (2,119)
PTNCS

>  <AMOUNT_CURRENT> (2,119)
32.6

$$$$
WAY-347339
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    7.0094    3.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2972    4.8221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3214    2.3945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8046    6.0084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7012    9.6442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  9  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  2  0  0  0  0
  8  3  2  0  0  0  0
  9  6  1  0  0  0  0
 10  2  2  0  0  0  0
 11  4  2  0  0  0  0
 12 14  2  0  0  0  0
 13  3  1  0  0  0  0
 14  7  1  0  0  0  0
 15 12  1  0  0  0  0
 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
 18 16  1  0  0  0  0
 19 17  1  0  0  0  0
 20 19  1  0  0  0  0
 12  8  1  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,120)
2120

>  <Formula> (2,120)
C14H16Cl2N2O2

>  <MolWeight> (2,120)
315.19504

>  <PCAT_CMPD_ID> (2,120)
WAY-347339

>  <CNC_ID> (2,120)
359435204

>  <transfer_container_id> (2,120)
PTN000000075

>  <COMPOUND_NUMBER> (2,120)
WAY-347339

>  <BAR_CODE_NO> (2,120)
2557461

>  <LOCATION_CODE> (2,120)
PTNCS

>  <AMOUNT_CURRENT> (2,120)
32.6

$$$$
WAY-347363
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
   11.4042   -5.0042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0167   -3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3250  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
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  7  3  2  0  0  0  0
  8  4  1  0  0  0  0
  9  2  1  0  0  0  0
 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  1  0  0  0  0
 13  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 13  1  0  0  0  0
 16 12  1  0  0  0  0
 17 12  2  0  0  0  0
 18 16  2  0  0  0  0
 19 17  1  0  0  0  0
 20 19  2  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
  6  5  1  0  0  0  0
  7 11  1  0  0  0  0
 15 14  2  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,121)
2121

>  <Formula> (2,121)
C16H14N4S2

>  <MolWeight> (2,121)
326.43916

>  <PCAT_CMPD_ID> (2,121)
WAY-347363

>  <CNC_ID> (2,121)
359435226

>  <transfer_container_id> (2,121)
PTN000000075

>  <COMPOUND_NUMBER> (2,121)
WAY-347363

>  <BAR_CODE_NO> (2,121)
2557490

>  <LOCATION_CODE> (2,121)
PTNCS

>  <AMOUNT_CURRENT> (2,121)
32.1

$$$$
WAY-347385
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    9.0917   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 18  1  0  0  0  0
  8  1  1  0  0  0  0
  9 19  1  0  0  0  0
 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 12  9  2  0  0  0  0
 13 10  1  0  0  0  0
 14 12  1  0  0  0  0
 15  7  2  0  0  0  0
 16  5  1  0  0  0  0
 17  6  2  0  0  0  0
 18  8  1  0  0  0  0
 19 11  1  0  0  0  0
 20 16  2  0  0  0  0
 21 17  1  0  0  0  0
  4  5  2  0  0  0  0
 17 20  1  0  0  0  0
 14 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,122)
2122

>  <Formula> (2,122)
C14H12ClN3O2S

>  <MolWeight> (2,122)
321.78198

>  <PCAT_CMPD_ID> (2,122)
WAY-347385

>  <CNC_ID> (2,122)
359435248

>  <transfer_container_id> (2,122)
PTN000000075

>  <COMPOUND_NUMBER> (2,122)
WAY-347385

>  <BAR_CODE_NO> (2,122)
2557538

>  <LOCATION_CODE> (2,122)
PTNCS

>  <AMOUNT_CURRENT> (2,122)
32.3

$$$$
WAY-347392
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   10.2667  -10.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0917  -12.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1792   -9.0417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4917   -2.8125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1042   -5.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5917  -14.5542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8167   -3.1750    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.9792  -15.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3542  -13.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5542    0.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9417    0.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3625  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6542    1.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8250    1.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7 14  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  1  0  0  0  0
 10  7  1  0  0  0  0
 11 12  1  0  0  0  0
 12  9  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15  8  2  0  0  0  0
 16 10  2  0  0  0  0
 17  9  2  0  0  0  0
 18 11  1  0  0  0  0
 19 11  1  0  0  0  0
 20  8  1  0  0  0  0
 21 16  1  0  0  0  0
 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
 24 10  1  0  0  0  0
 25 16  1  0  0  0  0
 26 20  1  0  0  0  0
 27 24  2  0  0  0  0
 28 27  1  0  0  0  0
  4  5  2  0  0  0  0
  7 13  1  0  0  0  0
 25 28  2  0  0  0  0
M  END
>  <Mol_ID> (2,123)
2123

>  <Formula> (2,123)
C20H24ClN3O3S

>  <MolWeight> (2,123)
421.94086

>  <PCAT_CMPD_ID> (2,123)
WAY-347392

>  <CNC_ID> (2,123)
359435255

>  <transfer_container_id> (2,123)
PTN000000075

>  <COMPOUND_NUMBER> (2,123)
WAY-347392

>  <BAR_CODE_NO> (2,123)
2557701

>  <LOCATION_CODE> (2,123)
PTNCS

>  <AMOUNT_CURRENT> (2,123)
32.5

$$$$
WAY-347441
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   14.1792   -6.8417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000   -5.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.0000   -6.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1292   -8.0167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9125   -7.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -5.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  6  2  2  0  0  0  0
  7  1  1  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 23  1  0  0  0  0
 13 21  1  0  0  0  0
 14  6  1  0  0  0  0
 15  4  2  0  0  0  0
 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
 18  7  2  0  0  0  0
 19  7  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22  9  2  0  0  0  0
 23 17  1  0  0  0  0
 24 16  1  0  0  0  0
 25 22  1  0  0  0  0
 26 22  1  0  0  0  0
 27 12  1  0  0  0  0
 28  8  1  0  0  0  0
 29  8  1  0  0  0  0
 20 13  2  0  0  0  0
 14 25  2  0  0  0  0
 24 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,124)
2124

>  <Formula> (2,124)
C20H25ClN4O3S

>  <MolWeight> (2,124)
436.9555

>  <PCAT_CMPD_ID> (2,124)
WAY-347441

>  <CNC_ID> (2,124)
359435303

>  <transfer_container_id> (2,124)
PTN000000075

>  <COMPOUND_NUMBER> (2,124)
WAY-347441

>  <BAR_CODE_NO> (2,124)
2557583

>  <LOCATION_CODE> (2,124)
PTNCS

>  <AMOUNT_CURRENT> (2,124)
32.8

$$$$
WAY-347462
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   11.3667   -6.6125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1542   -6.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3500   -7.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5292   -5.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.4167   -4.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3875   -8.7375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.7667   -6.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5625   -3.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9292   -5.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1542   -3.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -3.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9  7  1  0  0  0  0
 10  4  2  0  0  0  0
 11  7  2  0  0  0  0
 12  3  1  0  0  0  0
 13  6  2  0  0  0  0
 14  9  2  0  0  0  0
 15 21  1  0  0  0  0
 16 11  1  0  0  0  0
 17 16  2  0  0  0  0
 18  8  1  0  0  0  0
 19  8  1  0  0  0  0
 20  9  1  0  0  0  0
 21 19  1  0  0  0  0
 22 18  1  0  0  0  0
 23 17  1  0  0  0  0
  2  5  1  0  0  0  0
 17 14  1  0  0  0  0
 15 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,125)
2125

>  <Formula> (2,125)
C16H19N3O2S2

>  <MolWeight> (2,125)
349.47096

>  <PCAT_CMPD_ID> (2,125)
WAY-347462

>  <CNC_ID> (2,125)
359435323

>  <transfer_container_id> (2,125)
PTN000000075

>  <COMPOUND_NUMBER> (2,125)
WAY-347462

>  <BAR_CODE_NO> (2,125)
2558321

>  <LOCATION_CODE> (2,125)
PTNCS

>  <AMOUNT_CURRENT> (2,125)
32.2

$$$$
WAY-347476
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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   12.7750   -7.0667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -7.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4292   -6.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  8  4  1  0  0  0  0
  9  6  1  0  0  0  0
 10  2  1  0  0  0  0
 11 15  1  0  0  0  0
 12  7  2  0  0  0  0
 13  1  1  0  0  0  0
 14 11  2  0  0  0  0
 15  8  1  0  0  0  0
 16 13  1  0  0  0  0
 17 10  1  0  0  0  0
 18 10  2  0  0  0  0
 19 16  2  0  0  0  0
 20  7  1  0  0  0  0
 21 22  2  0  0  0  0
 22 18  1  0  0  0  0
 23 17  2  0  0  0  0
 24 21  1  0  0  0  0
 25  9  2  0  0  0  0
 26 27  2  0  0  0  0
 27 25  1  0  0  0  0
  5  3  1  0  0  0  0
 21 23  1  0  0  0  0
 12 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,126)
2126

>  <Formula> (2,126)
C18H15Cl2N5OS

>  <MolWeight> (2,126)
420.3156

>  <PCAT_CMPD_ID> (2,126)
WAY-347476

>  <CNC_ID> (2,126)
359435337

>  <transfer_container_id> (2,126)
PTN000000075

>  <COMPOUND_NUMBER> (2,126)
WAY-347476

>  <BAR_CODE_NO> (2,126)
2557606

>  <LOCATION_CODE> (2,126)
PTNCS

>  <AMOUNT_CURRENT> (2,126)
32.3

$$$$
WAY-347639
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
    6.0042   -0.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  8  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  2  2  0  0  0  0
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 13  3  1  0  0  0  0
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 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 14  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22  5  1  0  0  0  0
 23  6  1  0  0  0  0
 24  9  1  0  0  0  0
 25  9  1  0  0  0  0
 26 13  2  0  0  0  0
 27 13  1  0  0  0  0
 28 22  2  0  0  0  0
 29 23  2  0  0  0  0
 30 27  2  0  0  0  0
 31 26  1  0  0  0  0
 32 30  1  0  0  0  0
  5  6  2  0  0  0  0
 28 29  1  0  0  0  0
 32 31  2  0  0  0  0
 17  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,127)
2127

>  <Formula> (2,127)
C23H22N4O3S2

>  <MolWeight> (2,127)
466.57578

>  <PCAT_CMPD_ID> (2,127)
WAY-347639

>  <CNC_ID> (2,127)
359435492

>  <transfer_container_id> (2,127)
PTN000000075

>  <COMPOUND_NUMBER> (2,127)
WAY-347639

>  <BAR_CODE_NO> (2,127)
2557785

>  <LOCATION_CODE> (2,127)
PTNCS

>  <AMOUNT_CURRENT> (2,127)
32.6

$$$$
WAY-347675
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    2.1917   -4.3042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5125   -3.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1917   -2.3792    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   11.9500  -14.2667    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    7.1042  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5 13  1  0  0  0  0
  6  9  1  0  0  0  0
  7  4  1  0  0  0  0
  8  5  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  2  0  0  0  0
 11  6  2  0  0  0  0
 12  5  2  0  0  0  0
 13  7  1  0  0  0  0
 14 11  1  0  0  0  0
 15  3  1  0  0  0  0
 16  6  1  0  0  0  0
 17 11  1  0  0  0  0
 18 16  2  0  0  0  0
 19 18  1  0  0  0  0
  2  3  1  0  0  0  0
 19 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,128)
2128

>  <Formula> (2,128)
C14H16ClNO3

>  <MolWeight> (2,128)
281.73474

>  <PCAT_CMPD_ID> (2,128)
WAY-347675

>  <CNC_ID> (2,128)
359435527

>  <transfer_container_id> (2,128)
PTN000000075

>  <COMPOUND_NUMBER> (2,128)
WAY-347675

>  <BAR_CODE_NO> (2,128)
2558112

>  <LOCATION_CODE> (2,128)
PTNCS

>  <AMOUNT_CURRENT> (2,128)
33

$$$$
WAY-347759
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
    4.4500   -1.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8917   -2.2667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8000   -2.3250    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    8.2500   -2.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  2  0  0  0  0
  9  5  1  0  0  0  0
 10  5  2  0  0  0  0
 11  9  1  0  0  0  0
 12  7  2  0  0  0  0
 13  8  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16 11  1  0  0  0  0
 17  9  1  0  0  0  0
 18 17  1  0  0  0  0
  7  6  1  0  0  0  0
 14 13  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,129)
2129

>  <Formula> (2,129)
C12H11ClN2O2S

>  <MolWeight> (2,129)
282.74594

>  <PCAT_CMPD_ID> (2,129)
WAY-347759

>  <CNC_ID> (2,129)
359435608

>  <transfer_container_id> (2,129)
PTN000000075

>  <COMPOUND_NUMBER> (2,129)
WAY-347759

>  <BAR_CODE_NO> (2,129)
2557942

>  <LOCATION_CODE> (2,129)
PTNCS

>  <AMOUNT_CURRENT> (2,129)
32.9

$$$$
WAY-347787
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   -4.2708   -7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4458   -5.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9625   -3.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8417   -5.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8583   -7.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8417   -1.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2667  -12.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  2  2  0  0  0  0
  5 14  1  0  0  0  0
  6  1  1  0  0  0  0
  7 13  1  0  0  0  0
  8  5  1  0  0  0  0
  9  1  2  0  0  0  0
 10  2  1  0  0  0  0
 11  5  2  0  0  0  0
 12 18  1  0  0  0  0
 13 10  2  0  0  0  0
 14  6  1  0  0  0  0
 15  3  1  0  0  0  0
 16  7  1  0  0  0  0
 17  8  1  0  0  0  0
 18 17  1  0  0  0  0
 19 12  1  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
  7  3  2  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,130)
2130

>  <Formula> (2,130)
C14H17ClN2O4

>  <MolWeight> (2,130)
312.74878

>  <PCAT_CMPD_ID> (2,130)
WAY-347787

>  <CNC_ID> (2,130)
359435635

>  <transfer_container_id> (2,130)
PTN000000075

>  <COMPOUND_NUMBER> (2,130)
WAY-347787

>  <BAR_CODE_NO> (2,130)
2558030

>  <LOCATION_CODE> (2,130)
PTNCS

>  <AMOUNT_CURRENT> (2,130)
32.9

$$$$
WAY-348461
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   12.3292  -11.7625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7167  -12.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7125  -10.7042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   12.3250   -9.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1500   -8.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  5  1  0  0  0  0
 10  9  1  0  0  0  0
 11  6  1  0  0  0  0
 12  2  2  0  0  0  0
 13  4  2  0  0  0  0
 14  6  2  0  0  0  0
 15 11  1  0  0  0  0
 16 14  1  0  0  0  0
 17  8  1  0  0  0  0
 18  9  2  0  0  0  0
 19 10  2  0  0  0  0
 20 17  1  0  0  0  0
 21 17  2  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
 24 20  2  0  0  0  0
 25 21  1  0  0  0  0
 26 25  2  0  0  0  0
 10  7  1  0  0  0  0
 16 15  2  0  0  0  0
 19 22  1  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,131)
2131

>  <Formula> (2,131)
C21H18N2O3

>  <MolWeight> (2,131)
346.37922

>  <PCAT_CMPD_ID> (2,131)
WAY-348461

>  <CNC_ID> (2,131)
359436274

>  <transfer_container_id> (2,131)
PTN000000075

>  <COMPOUND_NUMBER> (2,131)
WAY-348461

>  <BAR_CODE_NO> (2,131)
2558678

>  <LOCATION_CODE> (2,131)
PTNCS

>  <AMOUNT_CURRENT> (2,131)
32.2

$$$$
WAY-348544
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   12.4250  -10.6292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  3  1  0  0  0  0
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 27 11  2  0  0  0  0
 28 25  1  0  0  0  0
 29 26  1  0  0  0  0
 30 27  1  0  0  0  0
 23 14  1  0  0  0  0
 28 18  2  0  0  0  0
 10 11  1  0  0  0  0
 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,132)
2132

>  <Formula> (2,132)
C21H17ClN4O3S

>  <MolWeight> (2,132)
440.90268

>  <PCAT_CMPD_ID> (2,132)
WAY-348544

>  <CNC_ID> (2,132)
359436355

>  <transfer_container_id> (2,132)
PTN000000075

>  <COMPOUND_NUMBER> (2,132)
WAY-348544

>  <BAR_CODE_NO> (2,132)
2558767

>  <LOCATION_CODE> (2,132)
PTNCS

>  <AMOUNT_CURRENT> (2,132)
29.5

$$$$
WAY-348605
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    8.1000   -4.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6917   -5.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5417   -2.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0667   -3.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4375   -6.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0292   -7.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  2  0  0  0  0
 10 20  1  0  0  0  0
 11 21  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14  6  2  0  0  0  0
 15  6  1  0  0  0  0
 16 11  2  0  0  0  0
 17 12  1  0  0  0  0
 18 16  1  0  0  0  0
 19 10  2  0  0  0  0
 20  8  1  0  0  0  0
 21 13  1  0  0  0  0
 22  5  2  0  0  0  0
 23  7  2  0  0  0  0
 24 25  1  0  0  0  0
 25 15  2  0  0  0  0
 26 14  1  0  0  0  0
 27 15  1  0  0  0  0
 28 14  1  0  0  0  0
 29 22  1  0  0  0  0
 30 29  2  0  0  0  0
 26 24  2  0  0  0  0
  4  7  1  0  0  0  0
 30 23  1  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,133)
2133

>  <Formula> (2,133)
C23H21N3O3S

>  <MolWeight> (2,133)
419.49614

>  <PCAT_CMPD_ID> (2,133)
WAY-348605

>  <CNC_ID> (2,133)
359436416

>  <transfer_container_id> (2,133)
PTN000000075

>  <COMPOUND_NUMBER> (2,133)
WAY-348605

>  <BAR_CODE_NO> (2,133)
2558810

>  <LOCATION_CODE> (2,133)
PTNCS

>  <AMOUNT_CURRENT> (2,133)
29.7

$$$$
WAY-348713
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    1.2269    8.3541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9343    7.1471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7845    3.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7 14  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  2  0  0  0  0
 10  3  1  0  0  0  0
 11  2  2  0  0  0  0
 12  7  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 10  2  0  0  0  0
 16 15  1  0  0  0  0
 17  9  1  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
  6  5  1  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,134)
2134

>  <Formula> (2,134)
C14H17NO4

>  <MolWeight> (2,134)
263.28908

>  <PCAT_CMPD_ID> (2,134)
WAY-348713

>  <CNC_ID> (2,134)
359436524

>  <transfer_container_id> (2,134)
PTN000000075

>  <COMPOUND_NUMBER> (2,134)
WAY-348713

>  <BAR_CODE_NO> (2,134)
2558952

>  <LOCATION_CODE> (2,134)
PTNCS

>  <AMOUNT_CURRENT> (2,134)
32.8

$$$$
WAY-348718
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.2375   -4.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7 11  1  0  0  0  0
  8 10  1  0  0  0  0
  9  4  1  0  0  0  0
 10  7  1  0  0  0  0
 11 16  1  0  0  0  0
 12  6  1  0  0  0  0
 13  8  2  0  0  0  0
 14  2  1  0  0  0  0
 15 11  2  0  0  0  0
 16  9  1  0  0  0  0
 17 14  1  0  0  0  0
 18 17  2  0  0  0  0
 19  8  1  0  0  0  0
 20 12  1  0  0  0  0
 21  6  2  0  0  0  0
 22 10  2  0  0  0  0
 23 26  2  0  0  0  0
 24 12  2  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
 27 25  2  0  0  0  0
  5  4  2  0  0  0  0
 24 27  1  0  0  0  0
 13 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,135)
2135

>  <Formula> (2,135)
C18H15ClFN5OS

>  <MolWeight> (2,135)
403.8610032

>  <PCAT_CMPD_ID> (2,135)
WAY-348718

>  <CNC_ID> (2,135)
359436529

>  <transfer_container_id> (2,135)
PTN000000075

>  <COMPOUND_NUMBER> (2,135)
WAY-348718

>  <BAR_CODE_NO> (2,135)
2558958

>  <LOCATION_CODE> (2,135)
PTNCS

>  <AMOUNT_CURRENT> (2,135)
32.8

$$$$
WAY-348818
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   12.4917   -6.2750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  6  3  0  0  0  0
  5  7  1  0  0  0  0
  6 17  1  0  0  0  0
  7 15  2  0  0  0  0
  8 16  1  0  0  0  0
  9  5  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14  2  2  0  0  0  0
 15 13  1  0  0  0  0
 16 19  2  0  0  0  0
 17 18  1  0  0  0  0
 18  1  1  0  0  0  0
 19 15  1  0  0  0  0
 20 11  1  0  0  0  0
 21  3  2  0  0  0  0
 22  9  1  0  0  0  0
 23 12  1  0  0  0  0
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 25 20  1  0  0  0  0
 26 21  1  0  0  0  0
 27 26  2  0  0  0  0
 27 24  1  0  0  0  0
  5  8  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,136)
2136

>  <Formula> (2,136)
C20H20N2O4S

>  <MolWeight> (2,136)
384.4488

>  <PCAT_CMPD_ID> (2,136)
WAY-348818

>  <CNC_ID> (2,136)
359436627

>  <transfer_container_id> (2,136)
PTN000000075

>  <COMPOUND_NUMBER> (2,136)
WAY-348818

>  <BAR_CODE_NO> (2,136)
2559468

>  <LOCATION_CODE> (2,136)
PTNCS

>  <AMOUNT_CURRENT> (2,136)
32.1

$$$$
WAY-348838
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    9.1542   -4.5417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9417   -4.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.0167   -8.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.8042   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5500   -3.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7417   -4.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9792   -2.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9375   -2.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6917   -4.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7792   -2.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  8  1  0  0  0  0
  7  6  2  0  0  0  0
  8 13  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11  9  3  0  0  0  0
 12  4  1  0  0  0  0
 13 18  1  0  0  0  0
 14  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16  2  1  0  0  0  0
 17 13  2  0  0  0  0
 18 12  1  0  0  0  0
 19  1  1  0  0  0  0
 20 16  2  0  0  0  0
 21 16  1  0  0  0  0
 22 21  2  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
  3  5  1  0  0  0  0
 24 23  2  0  0  0  0
 15 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,137)
2137

>  <Formula> (2,137)
C16H13N5OS2

>  <MolWeight> (2,137)
355.43732

>  <PCAT_CMPD_ID> (2,137)
WAY-348838

>  <CNC_ID> (2,137)
359436647

>  <transfer_container_id> (2,137)
PTN000000075

>  <COMPOUND_NUMBER> (2,137)
WAY-348838

>  <BAR_CODE_NO> (2,137)
2559038

>  <LOCATION_CODE> (2,137)
PTNCS

>  <AMOUNT_CURRENT> (2,137)
32.2

$$$$
WAY-348926
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.5667   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7792   -6.8542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1417   -9.9792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5042   -8.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4167   -7.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9750   -7.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6000   -8.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9417   -5.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8250   -8.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7542   -7.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6417   -7.8875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.2750   -8.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1042   -7.8417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4250  -12.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7167   -5.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1250   -6.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3667  -10.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5667  -11.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0792   -4.8042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0042  -10.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -11.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2000  -12.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6667   -3.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4 12  1  0  0  0  0
  5  2  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  1  2  0  0  0  0
  9  7  2  0  0  0  0
 10  6  2  0  0  0  0
 11  5  1  0  0  0  0
 12 11  1  0  0  0  0
 13  4  2  0  0  0  0
 14 22  1  0  0  0  0
 15  8  1  0  0  0  0
 16 15  2  0  0  0  0
 17  3  1  0  0  0  0
 18  3  1  0  0  0  0
 19 15  1  0  0  0  0
 20  7  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 19  1  0  0  0  0
 10 16  1  0  0  0  0
  5  9  1  0  0  0  0
 21 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,138)
2138

>  <Formula> (2,138)
C17H20N2O3S

>  <MolWeight> (2,138)
332.4173

>  <PCAT_CMPD_ID> (2,138)
WAY-348926

>  <CNC_ID> (2,138)
359436732

>  <transfer_container_id> (2,138)
PTN000000075

>  <COMPOUND_NUMBER> (2,138)
WAY-348926

>  <BAR_CODE_NO> (2,138)
2559155

>  <LOCATION_CODE> (2,138)
PTNCS

>  <AMOUNT_CURRENT> (2,138)
32.8

$$$$
WAY-349050
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   10.6042   -6.0292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3250   -7.9417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2750   -6.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5000   -7.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7000   -8.3375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.3292  -13.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -11.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1292   -8.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9042  -13.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9000   -9.4167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8250  -14.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9292   -7.0875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.5167  -14.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2375  -10.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7000  -15.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7792   -6.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0875   -5.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1417  -12.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6917   -8.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8042  -10.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -4.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8042   -6.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  1  0  0  0  0
  7 14  2  0  0  0  0
  8 19  1  0  0  0  0
  9 18  1  0  0  0  0
 10  8  1  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16  8  2  0  0  0  0
 17  3  1  0  0  0  0
 18 20  2  0  0  0  0
 19 12  1  0  0  0  0
 20 14  1  0  0  0  0
 21 17  1  0  0  0  0
 22 17  1  0  0  0  0
  5  2  1  0  0  0  0
  9  6  2  0  0  0  0
 13 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,139)
2139

>  <Formula> (2,139)
C14H16N4O3S

>  <MolWeight> (2,139)
320.36684

>  <PCAT_CMPD_ID> (2,139)
WAY-349050

>  <CNC_ID> (2,139)
359436846

>  <transfer_container_id> (2,139)
PTN000000075

>  <COMPOUND_NUMBER> (2,139)
WAY-349050

>  <BAR_CODE_NO> (2,139)
2559196

>  <LOCATION_CODE> (2,139)
PTNCS

>  <AMOUNT_CURRENT> (2,139)
32.3

$$$$
WAY-349121
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    8.1042  -10.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3542   -9.9667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1167  -11.6917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.1167  -11.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3750  -12.0792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0292  -13.2667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0625   -9.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3792  -12.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4250  -11.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.1500   -8.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0750  -12.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -9.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3875  -14.3917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.0292  -11.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9292   -7.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1042   -8.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3417  -13.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0667  -14.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0417  -15.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -14.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4042  -15.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3417  -15.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  8  1  0  0  0  0
  7  1  1  0  0  0  0
  8 11  1  0  0  0  0
  9  4  1  0  0  0  0
 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  2  0  0  0  0
 13  6  1  0  0  0  0
 14  8  2  0  0  0  0
 15 10  1  0  0  0  0
 16 12  1  0  0  0  0
 17  6  1  0  0  0  0
 18 13  1  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 22 20  1  0  0  0  0
  4  5  2  0  0  0  0
 16 15  2  0  0  0  0
 19 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,140)
2140

>  <Formula> (2,140)
C15H19N3O3S

>  <MolWeight> (2,140)
321.39466

>  <PCAT_CMPD_ID> (2,140)
WAY-349121

>  <CNC_ID> (2,140)
359436916

>  <transfer_container_id> (2,140)
PTN000000075

>  <COMPOUND_NUMBER> (2,140)
WAY-349121

>  <BAR_CODE_NO> (2,140)
2559829

>  <LOCATION_CODE> (2,140)
PTNCS

>  <AMOUNT_CURRENT> (2,140)
32.1

$$$$
WAY-349160
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   11.7542  -11.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9167  -11.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1625  -12.9250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2875  -12.7542    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.1667  -13.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1542  -10.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9875  -10.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4042   -9.6750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2292   -9.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6375   -8.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6875  -10.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4125  -11.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4625   -8.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3125   -9.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8375  -11.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6042  -10.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0792   -8.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2292   -9.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0625  -14.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4750  -10.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2000   -7.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8792   -9.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8542   -7.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
 12  7  2  0  0  0  0
 13 10  2  0  0  0  0
 14 11  2  0  0  0  0
 15 11  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18 16  1  0  0  0  0
 19  9  2  0  0  0  0
 20  5  1  0  0  0  0
 21 19  1  0  0  0  0
 22 10  1  0  0  0  0
 23 21  2  0  0  0  0
 24 13  1  0  0  0  0
 25 18  1  0  0  0  0
  5  3  2  0  0  0  0
 18 17  2  0  0  0  0
 13 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,141)
2141

>  <Formula> (2,141)
C21H22N2OS

>  <MolWeight> (2,141)
350.47718

>  <PCAT_CMPD_ID> (2,141)
WAY-349160

>  <CNC_ID> (2,141)
359436955

>  <transfer_container_id> (2,141)
PTN000000075

>  <COMPOUND_NUMBER> (2,141)
WAY-349160

>  <BAR_CODE_NO> (2,141)
2559394

>  <LOCATION_CODE> (2,141)
PTNCS

>  <AMOUNT_CURRENT> (2,141)
29.1

$$$$
WAY-349233
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.8500   -8.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8417   -9.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2000  -10.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1667   -8.0292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2167   -9.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1750   -9.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3167   -8.0750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9000  -10.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1292  -10.4167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2042   -3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9292   -8.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  8  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  9  1  0  0  0  0
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 10  6  2  0  0  0  0
 11 19  2  0  0  0  0
 12  5  2  0  0  0  0
 13  2  2  0  0  0  0
 14  8  2  0  0  0  0
 15  3  1  0  0  0  0
 16  3  1  0  0  0  0
 17  3  1  0  0  0  0
 18 26  1  0  0  0  0
 19  5  1  0  0  0  0
 20 12  1  0  0  0  0
 21 20  1  0  0  0  0
 22  7  1  0  0  0  0
 23  7  1  0  0  0  0
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 25 22  1  0  0  0  0
 26 23  1  0  0  0  0
 10 14  1  0  0  0  0
 18 25  1  0  0  0  0
 20 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,142)
2142

>  <Formula> (2,142)
C17H15BrF3N3O2

>  <MolWeight> (2,142)
430.2191096

>  <PCAT_CMPD_ID> (2,142)
WAY-349233

>  <CNC_ID> (2,142)
359437026

>  <transfer_container_id> (2,142)
PTN000000075

>  <COMPOUND_NUMBER> (2,142)
WAY-349233

>  <BAR_CODE_NO> (2,142)
2559389

>  <LOCATION_CODE> (2,142)
PTNCS

>  <AMOUNT_CURRENT> (2,142)
32.4

$$$$
WAY-349277
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    3.6724    2.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5084    5.9335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  1  2  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  1  1  0  0  0  0
 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12  9  2  0  0  0  0
 13  3  2  0  0  0  0
 14  8  1  0  0  0  0
 15  6  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18 16  2  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
 12 10  1  0  0  0  0
  8 11  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,143)
2143

>  <Formula> (2,143)
C15H14N2O2S

>  <MolWeight> (2,143)
286.34886

>  <PCAT_CMPD_ID> (2,143)
WAY-349277

>  <CNC_ID> (2,143)
359437066

>  <transfer_container_id> (2,143)
PTN000000075

>  <COMPOUND_NUMBER> (2,143)
WAY-349277

>  <BAR_CODE_NO> (2,143)
2559520

>  <LOCATION_CODE> (2,143)
PTNCS

>  <AMOUNT_CURRENT> (2,143)
32.4

$$$$
WAY-349320
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.4792   -3.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  8  1  0  0  0  0
  8  5  1  0  0  0  0
  9  7  1  0  0  0  0
 10  1  1  0  0  0  0
 11  1  1  0  0  0  0
 12  2  2  0  0  0  0
 13  3  2  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 11  1  0  0  0  0
 17 10  1  0  0  0  0
 18 19  2  0  0  0  0
 19 13  1  0  0  0  0
 20 14  1  0  0  0  0
 21 15  2  0  0  0  0
 22 16  1  0  0  0  0
 23 21  1  0  0  0  0
 17 22  1  0  0  0  0
 18 12  1  0  0  0  0
 20 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,144)
2144

>  <Formula> (2,144)
C19H22N2O2

>  <MolWeight> (2,144)
310.39018

>  <PCAT_CMPD_ID> (2,144)
WAY-349320

>  <CNC_ID> (2,144)
359437107

>  <transfer_container_id> (2,144)
PTN000000075

>  <COMPOUND_NUMBER> (2,144)
WAY-349320

>  <BAR_CODE_NO> (2,144)
2559553

>  <LOCATION_CODE> (2,144)
PTNCS

>  <AMOUNT_CURRENT> (2,144)
32.5

$$$$
WAY-349422
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   10.7250   -5.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  9  1  0  0  0  0
  4  2  1  0  0  0  0
  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  1  1  0  0  0  0
  9 16  2  0  0  0  0
 10  3  2  0  0  0  0
 11  3  2  0  0  0  0
 12  5  2  0  0  0  0
 13  3  1  0  0  0  0
 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16 20  1  0  0  0  0
 17 19  2  0  0  0  0
 18  4  1  0  0  0  0
 19 21  1  0  0  0  0
 20 21  2  0  0  0  0
 21 25  1  0  0  0  0
 22  6  2  0  0  0  0
 23  7  2  0  0  0  0
 24 15  1  0  0  0  0
 25 24  1  0  0  0  0
 26 18  1  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
 29 26  1  0  0  0  0
  5  4  1  0  0  0  0
 23 28  1  0  0  0  0
  9 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,145)
2145

>  <Formula> (2,145)
C20H22N4O4S

>  <MolWeight> (2,145)
414.47808

>  <PCAT_CMPD_ID> (2,145)
WAY-349422

>  <CNC_ID> (2,145)
359437206

>  <transfer_container_id> (2,145)
PTN000000075

>  <COMPOUND_NUMBER> (2,145)
WAY-349422

>  <BAR_CODE_NO> (2,145)
2559616

>  <LOCATION_CODE> (2,145)
PTNCS

>  <AMOUNT_CURRENT> (2,145)
32.2

$$$$
WAY-349511
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
    7.7042   -5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  5  2  0  0  0  0
 12  9  2  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15  3  1  0  0  0  0
 16 10  1  0  0  0  0
 17 16  1  0  0  0  0
 18 22  1  0  0  0  0
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 22 20  2  0  0  0  0
 23 18  1  0  0  0  0
 24 23  1  0  0  0  0
  2  5  1  0  0  0  0
 21 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,146)
2146

>  <Formula> (2,146)
C16H15F3N2O3

>  <MolWeight> (2,146)
340.2971096

>  <PCAT_CMPD_ID> (2,146)
WAY-349511

>  <CNC_ID> (2,146)
359437293

>  <transfer_container_id> (2,146)
PTN000000075

>  <COMPOUND_NUMBER> (2,146)
WAY-349511

>  <BAR_CODE_NO> (2,146)
2559743

>  <LOCATION_CODE> (2,146)
PTNCS

>  <AMOUNT_CURRENT> (2,146)
32.3

$$$$
WAY-349577
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11  3  1  0  0  0  0
 12  3  2  0  0  0  0
 13  2  1  0  0  0  0
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 18  7  1  0  0  0  0
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 24 20  1  0  0  0  0
 10  5  2  0  0  0  0
 19 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,147)
2147

>  <Formula> (2,147)
C16H24N2O5S

>  <MolWeight> (2,147)
356.43716

>  <PCAT_CMPD_ID> (2,147)
WAY-349577

>  <CNC_ID> (2,147)
359437358

>  <transfer_container_id> (2,147)
PTN000000075

>  <COMPOUND_NUMBER> (2,147)
WAY-349577

>  <BAR_CODE_NO> (2,147)
2559813

>  <LOCATION_CODE> (2,147)
PTNCS

>  <AMOUNT_CURRENT> (2,147)
32.8

$$$$
WAY-349677
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
 11  7  2  0  0  0  0
 12 10  1  0  0  0  0
 13 15  1  0  0  0  0
 14  9  1  0  0  0  0
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 17  8  1  0  0  0  0
 18  5  2  0  0  0  0
 19  6  2  0  0  0  0
 20 12  1  0  0  0  0
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 22  3  1  0  0  0  0
 23  4  1  0  0  0  0
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 28 24  2  0  0  0  0
 29 26  1  0  0  0  0
 11  8  1  0  0  0  0
  6  4  1  0  0  0  0
 12 16  2  0  0  0  0
 26 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,148)
2148

>  <Formula> (2,148)
C18H15FN6O3S

>  <MolWeight> (2,148)
414.4135032

>  <PCAT_CMPD_ID> (2,148)
WAY-349677

>  <CNC_ID> (2,148)
359437455

>  <transfer_container_id> (2,148)
PTN000000075

>  <COMPOUND_NUMBER> (2,148)
WAY-349677

>  <BAR_CODE_NO> (2,148)
2559933

>  <LOCATION_CODE> (2,148)
PTNCS

>  <AMOUNT_CURRENT> (2,148)
32.7

$$$$
WAY-349681
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10 19  1  0  0  0  0
 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14  9  1  0  0  0  0
 15 21  2  0  0  0  0
 16  6  2  0  0  0  0
 17  9  2  0  0  0  0
 18  7  1  0  0  0  0
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 20  1  1  0  0  0  0
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 24  6  1  0  0  0  0
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  5  3  1  0  0  0  0
 28 26  2  0  0  0  0
 10  8  2  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,149)
2149

>  <Formula> (2,149)
C20H20N4O3S

>  <MolWeight> (2,149)
396.4628

>  <PCAT_CMPD_ID> (2,149)
WAY-349681

>  <CNC_ID> (2,149)
359437459

>  <transfer_container_id> (2,149)
PTN000000075

>  <COMPOUND_NUMBER> (2,149)
WAY-349681

>  <BAR_CODE_NO> (2,149)
2561340

>  <LOCATION_CODE> (2,149)
PTNCS

>  <AMOUNT_CURRENT> (2,149)
32.5

$$$$
WAY-349708
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11 15  1  0  0  0  0
 12  8  1  0  0  0  0
 13  4  1  0  0  0  0
 14  5  1  0  0  0  0
 15 12  1  0  0  0  0
 16 11  2  0  0  0  0
 17 13  2  0  0  0  0
 18  1  1  0  0  0  0
 19  3  1  0  0  0  0
 20  9  1  0  0  0  0
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 27 26  1  0  0  0  0
 10  7  1  0  0  0  0
 27 25  2  0  0  0  0
  4  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,150)
2150

>  <Formula> (2,150)
C20H22N4O2S

>  <MolWeight> (2,150)
382.47928

>  <PCAT_CMPD_ID> (2,150)
WAY-349708

>  <CNC_ID> (2,150)
359437484

>  <transfer_container_id> (2,150)
PTN000000075

>  <COMPOUND_NUMBER> (2,150)
WAY-349708

>  <BAR_CODE_NO> (2,150)
2559956

>  <LOCATION_CODE> (2,150)
PTNCS

>  <AMOUNT_CURRENT> (2,150)
32.8

$$$$
WAY-349730
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12  3  2  0  0  0  0
 13  5  1  0  0  0  0
 14  7  2  0  0  0  0
 15 19  2  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
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 22 17  1  0  0  0  0
 23 17  2  0  0  0  0
 24 22  2  0  0  0  0
 25 23  1  0  0  0  0
 26 25  2  0  0  0  0
  5  4  1  0  0  0  0
 15 18  1  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,151)
2151

>  <Formula> (2,151)
C19H16N4O3

>  <MolWeight> (2,151)
348.35534

>  <PCAT_CMPD_ID> (2,151)
WAY-349730

>  <CNC_ID> (2,151)
359437505

>  <transfer_container_id> (2,151)
PTN000000075

>  <COMPOUND_NUMBER> (2,151)
WAY-349730

>  <BAR_CODE_NO> (2,151)
2559978

>  <LOCATION_CODE> (2,151)
PTNCS

>  <AMOUNT_CURRENT> (2,151)
32.5

$$$$
WAY-349795
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3 11  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7 14  2  0  0  0  0
  8  2  2  0  0  0  0
  9  1  1  0  0  0  0
 10  3  2  0  0  0  0
 11 20  1  0  0  0  0
 12  4  2  0  0  0  0
 13  4  1  0  0  0  0
 14  2  1  0  0  0  0
 15  8  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  2  0  0  0  0
 18 17  1  0  0  0  0
 19 15  1  0  0  0  0
 20 22  1  0  0  0  0
 21  7  1  0  0  0  0
 22 18  1  0  0  0  0
 16 18  2  0  0  0  0
 21 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,152)
2152

>  <Formula> (2,152)
C14H14BrN3O3S

>  <MolWeight> (2,152)
384.24826

>  <PCAT_CMPD_ID> (2,152)
WAY-349795

>  <CNC_ID> (2,152)
359437562

>  <transfer_container_id> (2,152)
PTN000000075

>  <COMPOUND_NUMBER> (2,152)
WAY-349795

>  <BAR_CODE_NO> (2,152)
2560074

>  <LOCATION_CODE> (2,152)
PTNCS

>  <AMOUNT_CURRENT> (2,152)
32.7

$$$$
WAY-349848
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  6  1  0  0  0  0
  5  7  2  0  0  0  0
  6  1  1  0  0  0  0
  7 14  1  0  0  0  0
  8 13  2  0  0  0  0
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 10  4  2  0  0  0  0
 11 17  1  0  0  0  0
 12 15  1  0  0  0  0
 13 11  1  0  0  0  0
 14 11  2  0  0  0  0
 15 20  2  0  0  0  0
 16  9  2  0  0  0  0
 17  9  1  0  0  0  0
 18  6  2  0  0  0  0
 19  5  1  0  0  0  0
 20 18  1  0  0  0  0
 21  7  1  0  0  0  0
 22  8  1  0  0  0  0
 23  3  1  0  0  0  0
 24 19  1  0  0  0  0
 25 22  1  0  0  0  0
 26 21  1  0  0  0  0
  2  4  1  0  0  0  0
 10 15  1  0  0  0  0
  5  8  1  0  0  0  0
M  END
>  <Mol_ID> (2,153)
2153

>  <Formula> (2,153)
C19H20N2O4S

>  <MolWeight> (2,153)
372.4381

>  <PCAT_CMPD_ID> (2,153)
WAY-349848

>  <CNC_ID> (2,153)
359437615

>  <transfer_container_id> (2,153)
PTN000000075

>  <COMPOUND_NUMBER> (2,153)
WAY-349848

>  <BAR_CODE_NO> (2,153)
2560142

>  <LOCATION_CODE> (2,153)
PTNCS

>  <AMOUNT_CURRENT> (2,153)
32

$$$$
WAY-350164
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  4  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  2  2  0  0  0  0
  7  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10 12  1  0  0  0  0
 11  9  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14  7  2  0  0  0  0
 15  4  1  0  0  0  0
 16 11  2  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19 15  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22 16  1  0  0  0  0
 23 17  1  0  0  0  0
  6  3  1  0  0  0  0
 11 13  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,154)
2154

>  <Formula> (2,154)
C16H19N3O3S

>  <MolWeight> (2,154)
333.40536

>  <PCAT_CMPD_ID> (2,154)
WAY-350164

>  <CNC_ID> (2,154)
359437915

>  <transfer_container_id> (2,154)
PTN000000075

>  <COMPOUND_NUMBER> (2,154)
WAY-350164

>  <BAR_CODE_NO> (2,154)
2560395

>  <LOCATION_CODE> (2,154)
PTNCS

>  <AMOUNT_CURRENT> (2,154)
32.6

$$$$
WAY-350176
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  7 10  1  0  0  0  0
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 10  5  1  0  0  0  0
 11 19  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15  4  1  0  0  0  0
 16 20  2  0  0  0  0
 17  7  2  0  0  0  0
 18  6  1  0  0  0  0
 19 24  2  0  0  0  0
 20 21  1  0  0  0  0
 21  9  1  0  0  0  0
 22 15  2  0  0  0  0
 23 18  2  0  0  0  0
 24 20  1  0  0  0  0
 25 10  1  0  0  0  0
 26 22  1  0  0  0  0
  4  6  2  0  0  0  0
 22 23  1  0  0  0  0
  8 11  2  0  0  0  0
 14 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,155)
2155

>  <Formula> (2,155)
C19H19N3O3S

>  <MolWeight> (2,155)
369.43746

>  <PCAT_CMPD_ID> (2,155)
WAY-350176

>  <CNC_ID> (2,155)
359437927

>  <transfer_container_id> (2,155)
PTN000000075

>  <COMPOUND_NUMBER> (2,155)
WAY-350176

>  <BAR_CODE_NO> (2,155)
2560409

>  <LOCATION_CODE> (2,155)
PTNCS

>  <AMOUNT_CURRENT> (2,155)
30.1

$$$$
WAY-350196
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 13  6  1  0  0  0  0
 14  8  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 14  1  0  0  0  0
 18 14  2  0  0  0  0
  7 11  2  0  0  0  0
 15  3  1  0  0  0  0
M  END
>  <Mol_ID> (2,156)
2156

>  <Formula> (2,156)
C14H13BrN2O

>  <MolWeight> (2,156)
305.16982

>  <PCAT_CMPD_ID> (2,156)
WAY-350196

>  <CNC_ID> (2,156)
359437947

>  <transfer_container_id> (2,156)
PTN000000075

>  <COMPOUND_NUMBER> (2,156)
WAY-350196

>  <BAR_CODE_NO> (2,156)
2560461

>  <LOCATION_CODE> (2,156)
PTNCS

>  <AMOUNT_CURRENT> (2,156)
32.3

$$$$
WAY-350217
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    9.4292  -10.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9625   -9.9250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9375  -15.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7625  -15.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  2  0  0  0  0
  4  8  1  0  0  0  0
  5  7  2  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  2  0  0  0  0
  9  6  1  0  0  0  0
 10  9  1  0  0  0  0
 11  1  2  0  0  0  0
 12 10  2  0  0  0  0
 13  5  1  0  0  0  0
 14  4  1  0  0  0  0
 15  3  1  0  0  0  0
 16 10  1  0  0  0  0
 17  9  1  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 20 21  1  0  0  0  0
 21 17  1  0  0  0  0
  3  5  1  0  0  0  0
 16 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,157)
2157

>  <Formula> (2,157)
C16H20O5

>  <MolWeight> (2,157)
292.327

>  <PCAT_CMPD_ID> (2,157)
WAY-350217

>  <CNC_ID> (2,157)
359437968

>  <transfer_container_id> (2,157)
PTN000000075

>  <COMPOUND_NUMBER> (2,157)
WAY-350217

>  <BAR_CODE_NO> (2,157)
2560533

>  <LOCATION_CODE> (2,157)
PTNCS

>  <AMOUNT_CURRENT> (2,157)
32.3

$$$$
WAY-349857
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
    8.4000   -5.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6417   -4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5542   -6.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3250  -10.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  9  2  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 10 17  1  0  0  0  0
 11  2  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15  4  2  0  0  0  0
 16  6  2  0  0  0  0
 17  6  1  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20  9  1  0  0  0  0
 21  8  1  0  0  0  0
 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
 24 20  1  0  0  0  0
 11 12  2  0  0  0  0
  5  8  1  0  0  0  0
M  END
>  <Mol_ID> (2,158)
2158

>  <Formula> (2,158)
C16H18N2O5S

>  <MolWeight> (2,158)
350.38952

>  <PCAT_CMPD_ID> (2,158)
WAY-349857

>  <CNC_ID> (2,158)
359437624

>  <transfer_container_id> (2,158)
PTN000000075

>  <COMPOUND_NUMBER> (2,158)
WAY-349857

>  <BAR_CODE_NO> (2,158)
2560151

>  <LOCATION_CODE> (2,158)
PTNCS

>  <AMOUNT_CURRENT> (2,158)
32.1

$$$$
WAY-349866
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   13.1125   -8.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1542   -7.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0417   -8.8292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 14  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  1  0  0  0  0
 14 19  1  0  0  0  0
 15 11  1  0  0  0  0
 16 15  1  0  0  0  0
 17 13  2  0  0  0  0
 18 13  1  0  0  0  0
 19 20  1  0  0  0  0
 20  8  1  0  0  0  0
 21  5  2  0  0  0  0
 22  6  2  0  0  0  0
 23 17  1  0  0  0  0
 24 18  2  0  0  0  0
 25 19  2  0  0  0  0
 26 24  1  0  0  0  0
 27  3  1  0  0  0  0
 28  4  1  0  0  0  0
 29 18  1  0  0  0  0
 30 17  1  0  0  0  0
 31 26  1  0  0  0  0
  8 12  1  0  0  0  0
  4  6  1  0  0  0  0
 16  9  2  0  0  0  0
 23 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,159)
2159

>  <Formula> (2,159)
C21H22N6O3S

>  <MolWeight> (2,159)
438.50278

>  <PCAT_CMPD_ID> (2,159)
WAY-349866

>  <CNC_ID> (2,159)
359437633

>  <transfer_container_id> (2,159)
PTN000000075

>  <COMPOUND_NUMBER> (2,159)
WAY-349866

>  <BAR_CODE_NO> (2,159)
2560162

>  <LOCATION_CODE> (2,159)
PTNCS

>  <AMOUNT_CURRENT> (2,159)
32.8

$$$$
WAY-349875
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -9.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  8  1  0  0  0  0
  5  1  2  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11  6  1  0  0  0  0
 12  3  2  0  0  0  0
 13  6  2  0  0  0  0
 14 11  2  0  0  0  0
 15  8  1  0  0  0  0
 16 14  1  0  0  0  0
 17 11  1  0  0  0  0
 18 17  2  0  0  0  0
 19 10  1  0  0  0  0
 20 18  1  0  0  0  0
 21 15  1  0  0  0  0
 22 15  1  0  0  0  0
 23 16  1  0  0  0  0
  9 10  2  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,160)
2160

>  <Formula> (2,160)
C17H21N3O2S

>  <MolWeight> (2,160)
331.43254

>  <PCAT_CMPD_ID> (2,160)
WAY-349875

>  <CNC_ID> (2,160)
359437642

>  <transfer_container_id> (2,160)
PTN000000075

>  <COMPOUND_NUMBER> (2,160)
WAY-349875

>  <BAR_CODE_NO> (2,160)
2560171

>  <LOCATION_CODE> (2,160)
PTNCS

>  <AMOUNT_CURRENT> (2,160)
32.7

$$$$
WAY-349911
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  9  1  0  0  0  0
  8 16  1  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11  1  1  0  0  0  0
 12  1  1  0  0  0  0
 13  2  1  0  0  0  0
 14  3  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  1  0  0  0  0
 17 10  2  0  0  0  0
 18 10  1  0  0  0  0
 19 20  1  0  0  0  0
 20 14  2  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23 22  1  0  0  0  0
 15  8  1  0  0  0  0
 13 19  2  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,161)
2161

>  <Formula> (2,161)
C18H20N2O2S

>  <MolWeight> (2,161)
328.4286

>  <PCAT_CMPD_ID> (2,161)
WAY-349911

>  <CNC_ID> (2,161)
359437676

>  <transfer_container_id> (2,161)
PTN000000075

>  <COMPOUND_NUMBER> (2,161)
WAY-349911

>  <BAR_CODE_NO> (2,161)
2560124

>  <LOCATION_CODE> (2,161)
PTNCS

>  <AMOUNT_CURRENT> (2,161)
32.5

$$$$
WAY-349918
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   10.0218    7.4985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7294    7.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7280    8.7228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0198    9.1302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3115    8.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3164    7.9023    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0204    6.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7351    6.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4499    6.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4511    7.4953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7248    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4407    5.4173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4362    6.2441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7166    6.6545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0080    5.4068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1521    6.6641    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8648    5.4190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5859    6.6683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3028    6.2532    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  1  7  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
 13 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,162)
2162

>  <Formula> (2,162)
C17H14N2O2

>  <MolWeight> (2,162)
278.30526

>  <PCAT_CMPD_ID> (2,162)
WAY-349918

>  <CNC_ID> (2,162)
359437683

>  <transfer_container_id> (2,162)
PTN000000075

>  <COMPOUND_NUMBER> (2,162)
WAY-349918

>  <BAR_CODE_NO> (2,162)
2560131

>  <LOCATION_CODE> (2,162)
PTNCS

>  <AMOUNT_CURRENT> (2,162)
32.7

$$$$
WAY-349920
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
   12.9625   -9.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0292   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9125   -9.8667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.9792   -8.2292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.9250   -9.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0292   -7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8667   -9.5417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9750   -7.7125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0042   -4.6417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6417   -5.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9167   -4.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2542   -8.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0167   -4.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7792   -5.6375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9417   -6.4792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.8750   -6.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3042   -6.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4500   -6.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8917   -9.9667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0917   -6.4792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9625   -4.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1792   -3.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7000   -7.6042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8500  -11.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0750   -3.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2875   -2.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8000   -5.8042    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.2292   -2.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4417   -1.3042    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 10  2  0  0  0  0
 10 14  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  2  0  0  0  0
 13 11  1  0  0  0  0
 14 17  1  0  0  0  0
 15 10  1  0  0  0  0
 16 15  1  0  0  0  0
 17 18  1  0  0  0  0
 18  8  1  0  0  0  0
 19  5  2  0  0  0  0
 20  6  2  0  0  0  0
 21 13  2  0  0  0  0
 22 13  1  0  0  0  0
 23 17  2  0  0  0  0
 24  3  1  0  0  0  0
 25  4  1  0  0  0  0
 26 21  1  0  0  0  0
 27 22  2  0  0  0  0
 28 21  1  0  0  0  0
 29 27  1  0  0  0  0
 30 27  1  0  0  0  0
  8 12  1  0  0  0  0
  4  6  1  0  0  0  0
 16 11  2  0  0  0  0
 29 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,163)
2163

>  <Formula> (2,163)
C18H14F2N6O3S

>  <MolWeight> (2,163)
432.4039664

>  <PCAT_CMPD_ID> (2,163)
WAY-349920

>  <CNC_ID> (2,163)
359437685

>  <transfer_container_id> (2,163)
PTN000000075

>  <COMPOUND_NUMBER> (2,163)
WAY-349920

>  <BAR_CODE_NO> (2,163)
2560133

>  <LOCATION_CODE> (2,163)
PTNCS

>  <AMOUNT_CURRENT> (2,163)
32.3

$$$$
WAY-349989
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   13.0917   -6.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7792   -7.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8292   -8.2875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7292   -3.1875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7875   -7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4917   -3.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3292   -6.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3500   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7375   -5.3250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792   -4.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5042   -5.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4667   -5.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5917   -4.2500    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -2.1292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8125   -9.5292    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.2167   -5.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0917   -4.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6125   -8.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6542   -4.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8917   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6875  -11.3875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7167  -10.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8750  -10.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5917  -11.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0375   -5.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6625   -6.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  8  1  0  0  0  0
  5  7  2  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8 13  1  0  0  0  0
  9  8  2  0  0  0  0
 10 11  1  0  0  0  0
 11  9  1  0  0  0  0
 12  1  1  0  0  0  0
 13 16  1  0  0  0  0
 14  6  2  0  0  0  0
 15  3  1  0  0  0  0
 16 12  1  0  0  0  0
 17 12  2  0  0  0  0
 18  2  1  0  0  0  0
 19  5  1  0  0  0  0
 20 10  2  0  0  0  0
 21 11  2  0  0  0  0
 22 23  1  0  0  0  0
 23 15  1  0  0  0  0
 24 15  1  0  0  0  0
 25 22  1  0  0  0  0
 26 27  2  0  0  0  0
 27 21  1  0  0  0  0
  3  5  1  0  0  0  0
  6 10  1  0  0  0  0
 26 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,164)
2164

>  <Formula> (2,164)
C20H23N3O3S

>  <MolWeight> (2,164)
385.47992

>  <PCAT_CMPD_ID> (2,164)
WAY-349989

>  <CNC_ID> (2,164)
359437749

>  <transfer_container_id> (2,164)
PTN000000075

>  <COMPOUND_NUMBER> (2,164)
WAY-349989

>  <BAR_CODE_NO> (2,164)
2560300

>  <LOCATION_CODE> (2,164)
PTNCS

>  <AMOUNT_CURRENT> (2,164)
32.9

$$$$
WAY-350003
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
   13.5292  -12.2042    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.6667   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3792   -4.6250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3625   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7500   -6.8167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1292  -11.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2750   -3.4292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6667  -12.8042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7792   -5.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4417   -9.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9292  -13.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3917  -11.6125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4667   -6.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6375   -6.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6417   -5.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3292   -7.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0250   -8.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2250   -5.5167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4667   -1.1417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3292   -6.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5625   -3.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5750   -2.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4042  -11.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7625  -12.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7250  -14.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3042   -8.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4792   -5.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1625   -2.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1667   -1.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -8.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5792   -8.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8875   -6.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  2  2  0  0  0  0
  4 15  1  0  0  0  0
  5  4  2  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9 13  1  0  0  0  0
 10  6  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  5  1  0  0  0  0
 14 16  1  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 10  1  0  0  0  0
 18 14  2  0  0  0  0
 19 30  1  0  0  0  0
 20 14  1  0  0  0  0
 21  7  1  0  0  0  0
 22  7  1  0  0  0  0
 23  6  1  0  0  0  0
 24 23  2  0  0  0  0
 25  8  1  0  0  0  0
 26  8  1  0  0  0  0
 27 24  1  0  0  0  0
 28  9  2  0  0  0  0
 29 21  1  0  0  0  0
 30 22  1  0  0  0  0
 31 13  2  0  0  0  0
 32 31  1  0  0  0  0
 33 32  2  0  0  0  0
 17 27  2  0  0  0  0
  3  9  1  0  0  0  0
 19 29  1  0  0  0  0
 28 33  1  0  0  0  0
M  END
>  <Mol_ID> (2,165)
2165

>  <Formula> (2,165)
C22H25N5O5S

>  <MolWeight> (2,165)
471.5294

>  <PCAT_CMPD_ID> (2,165)
WAY-350003

>  <CNC_ID> (2,165)
359437762

>  <transfer_container_id> (2,165)
PTN000000075

>  <COMPOUND_NUMBER> (2,165)
WAY-350003

>  <BAR_CODE_NO> (2,165)
2560432

>  <LOCATION_CODE> (2,165)
PTNCS

>  <AMOUNT_CURRENT> (2,165)
32.1

$$$$
WAY-350060
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   10.7417  -11.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9917  -11.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  2  0  0  0  0
  8  5  1  0  0  0  0
  9  3  1  0  0  0  0
 10 15  1  0  0  0  0
 11  5  2  0  0  0  0
 12  9  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 14  1  0  0  0  0
 16 17  1  0  0  0  0
 17 13  2  0  0  0  0
 18 12  1  0  0  0  0
 19 16  1  0  0  0  0
 20  6  1  0  0  0  0
 21  7  1  0  0  0  0
 22 10  2  0  0  0  0
 23 15  2  0  0  0  0
 24 20  2  0  0  0  0
 25 24  1  0  0  0  0
 26 27  2  0  0  0  0
 27 23  1  0  0  0  0
  3  2  2  0  0  0  0
 21 25  2  0  0  0  0
 16 18  2  0  0  0  0
 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,166)
2166

>  <Formula> (2,166)
C22H16BrN3O

>  <MolWeight> (2,166)
418.28594

>  <PCAT_CMPD_ID> (2,166)
WAY-350060

>  <CNC_ID> (2,166)
359437818

>  <transfer_container_id> (2,166)
PTN000000075

>  <COMPOUND_NUMBER> (2,166)
WAY-350060

>  <BAR_CODE_NO> (2,166)
2560313

>  <LOCATION_CODE> (2,166)
PTNCS

>  <AMOUNT_CURRENT> (2,166)
32.6

$$$$
WAY-350079
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   11.9250   -7.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5 12  1  0  0  0  0
  6  4  2  0  0  0  0
  7  5  2  0  0  0  0
  8  5  1  0  0  0  0
  9  7  1  0  0  0  0
 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  2  0  0  0  0
 15 16  1  0  0  0  0
 16  3  1  0  0  0  0
 17 15  2  0  0  0  0
 18  2  1  0  0  0  0
 19  6  1  0  0  0  0
 20  9  2  0  0  0  0
 21 11  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
  6  3  1  0  0  0  0
  9 11  1  0  0  0  0
 23 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,167)
2167

>  <Formula> (2,167)
C18H19N3OS

>  <MolWeight> (2,167)
325.42796

>  <PCAT_CMPD_ID> (2,167)
WAY-350079

>  <CNC_ID> (2,167)
359437836

>  <transfer_container_id> (2,167)
PTN000000075

>  <COMPOUND_NUMBER> (2,167)
WAY-350079

>  <BAR_CODE_NO> (2,167)
2560364

>  <LOCATION_CODE> (2,167)
PTNCS

>  <AMOUNT_CURRENT> (2,167)
32.8

$$$$
WAY-350088
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   13.2667   -7.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3042   -6.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9 13  1  0  0  0  0
 10  9  2  0  0  0  0
 11  7  2  0  0  0  0
 12 10  1  0  0  0  0
 13 15  1  0  0  0  0
 14  9  1  0  0  0  0
 15 17  1  0  0  0  0
 16 14  1  0  0  0  0
 17  8  1  0  0  0  0
 18  5  2  0  0  0  0
 19  6  2  0  0  0  0
 20 12  1  0  0  0  0
 21 15  2  0  0  0  0
 22  3  1  0  0  0  0
 23  4  1  0  0  0  0
 24 20  1  0  0  0  0
 25 20  2  0  0  0  0
 26 24  2  0  0  0  0
 27 25  1  0  0  0  0
 28 27  2  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
  8 11  1  0  0  0  0
  4  6  1  0  0  0  0
 16 12  2  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,168)
2168

>  <Formula> (2,168)
C21H22N6O3S

>  <MolWeight> (2,168)
438.50278

>  <PCAT_CMPD_ID> (2,168)
WAY-350088

>  <CNC_ID> (2,168)
359437843

>  <transfer_container_id> (2,168)
PTN000000075

>  <COMPOUND_NUMBER> (2,168)
WAY-350088

>  <BAR_CODE_NO> (2,168)
2560373

>  <LOCATION_CODE> (2,168)
PTNCS

>  <AMOUNT_CURRENT> (2,168)
32.2

$$$$
WAY-350107
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    5.8292   -4.9500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  6  8  1  0  0  0  0
  7  4  2  0  0  0  0
  8 10  1  0  0  0  0
  9 12  1  0  0  0  0
 10 18  2  0  0  0  0
 11 17  1  0  0  0  0
 12 14  2  0  0  0  0
 13  6  2  0  0  0  0
 14 16  1  0  0  0  0
 15  5  2  0  0  0  0
 16  6  1  0  0  0  0
 17 19  2  0  0  0  0
 18 15  1  0  0  0  0
 19 14  1  0  0  0  0
 20  9  1  0  0  0  0
 21 11  1  0  0  0  0
 22  3  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
  2  4  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,169)
2169

>  <Formula> (2,169)
C18H18N2O3S

>  <MolWeight> (2,169)
342.41212

>  <PCAT_CMPD_ID> (2,169)
WAY-350107

>  <CNC_ID> (2,169)
359437861

>  <transfer_container_id> (2,169)
PTN000000075

>  <COMPOUND_NUMBER> (2,169)
WAY-350107

>  <BAR_CODE_NO> (2,169)
2560336

>  <LOCATION_CODE> (2,169)
PTNCS

>  <AMOUNT_CURRENT> (2,169)
32.6

$$$$
WAY-350147
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  2  1  0  0  0  0
  7  4  1  0  0  0  0
  8 18  1  0  0  0  0
  9  1  1  0  0  0  0
 10 16  1  0  0  0  0
 11 15  1  0  0  0  0
 12 10  2  0  0  0  0
 13 10  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  2  0  0  0  0
 16 22  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19  6  2  0  0  0  0
 20  6  1  0  0  0  0
 21  7  1  0  0  0  0
 22 21  1  0  0  0  0
 23 11  1  0  0  0  0
  3  5  1  0  0  0  0
  8 17  2  0  0  0  0
 14 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,170)
2170

>  <Formula> (2,170)
C17H18N4OS

>  <MolWeight> (2,170)
326.41602

>  <PCAT_CMPD_ID> (2,170)
WAY-350147

>  <CNC_ID> (2,170)
359437898

>  <transfer_container_id> (2,170)
PTN000000075

>  <COMPOUND_NUMBER> (2,170)
WAY-350147

>  <BAR_CODE_NO> (2,170)
2560421

>  <LOCATION_CODE> (2,170)
PTNCS

>  <AMOUNT_CURRENT> (2,170)
30.6

$$$$
WAY-350277
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.2125   -5.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3292  -11.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4 14  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  2  0  0  0  0
  7  3  2  0  0  0  0
  8 13  2  0  0  0  0
  9  2  1  0  0  0  0
 10  1  2  0  0  0  0
 11  3  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  4  2  0  0  0  0
 16  6  1  0  0  0  0
 17 13  1  0  0  0  0
 18  5  1  0  0  0  0
 19  5  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
  6  8  1  0  0  0  0
  9 12  2  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,171)
2171

>  <Formula> (2,171)
C15H15Cl2N3O2

>  <MolWeight> (2,171)
340.2045

>  <PCAT_CMPD_ID> (2,171)
WAY-350277

>  <CNC_ID> (2,171)
359438023

>  <transfer_container_id> (2,171)
PTN000000075

>  <COMPOUND_NUMBER> (2,171)
WAY-350277

>  <BAR_CODE_NO> (2,171)
2560496

>  <LOCATION_CODE> (2,171)
PTNCS

>  <AMOUNT_CURRENT> (2,171)
32.6

$$$$
WAY-350318
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
    9.2792   -5.2292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9500   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3250   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3042   -7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9917   -7.5542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3167   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9792   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9750   -6.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2917   -6.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.9792  -11.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9917  -12.2042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3000   -4.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2667   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9542   -1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2792   -1.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.9750   -2.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9167   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3042   -1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6 12  1  0  0  0  0
  7 17  1  0  0  0  0
  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10 11  1  0  0  0  0
 11 13  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14  2  1  0  0  0  0
 15  6  2  0  0  0  0
 16  3  2  0  0  0  0
 17 14  1  0  0  0  0
 18 12  2  0  0  0  0
 19  9  1  0  0  0  0
 20 11  2  0  0  0  0
 21 22  2  0  0  0  0
 22 18  1  0  0  0  0
 23  5  2  0  0  0  0
 24 19  1  0  0  0  0
 25 21  1  0  0  0  0
 26  9  2  0  0  0  0
 27  8  2  0  0  0  0
 28 19  2  0  0  0  0
 29 24  1  0  0  0  0
 30 23  1  0  0  0  0
 31 26  1  0  0  0  0
 32 30  2  0  0  0  0
 33 31  2  0  0  0  0
  8  4  1  0  0  0  0
 33 28  1  0  0  0  0
 32 27  1  0  0  0  0
 10  6  1  0  0  0  0
 21 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,172)
2172

>  <Formula> (2,172)
C25H18N2O5S

>  <MolWeight> (2,172)
458.48582

>  <PCAT_CMPD_ID> (2,172)
WAY-350318

>  <CNC_ID> (2,172)
359438062

>  <transfer_container_id> (2,172)
PTN000000075

>  <COMPOUND_NUMBER> (2,172)
WAY-350318

>  <BAR_CODE_NO> (2,172)
2560565

>  <LOCATION_CODE> (2,172)
PTNCS

>  <AMOUNT_CURRENT> (2,172)
32.4

$$$$
WAY-350321
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   12.7375  -12.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4167  -13.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  2  0  0  0  0
 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13  5  1  0  0  0  0
 14  6  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  2  0  0  0  0
 17 12  1  0  0  0  0
 18 17  2  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
  6  4  1  0  0  0  0
 10  8  2  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,173)
2173

>  <Formula> (2,173)
C16H17N3S

>  <MolWeight> (2,173)
283.39128

>  <PCAT_CMPD_ID> (2,173)
WAY-350321

>  <CNC_ID> (2,173)
359438065

>  <transfer_container_id> (2,173)
PTN000000075

>  <COMPOUND_NUMBER> (2,173)
WAY-350321

>  <BAR_CODE_NO> (2,173)
2560568

>  <LOCATION_CODE> (2,173)
PTNCS

>  <AMOUNT_CURRENT> (2,173)
32.4

$$$$
WAY-350388
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9667   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7250  -11.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9167  -11.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 11  1  0  0  0  0
  4 10  1  0  0  0  0
  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  2  0  0  0  0
  8  5  1  0  0  0  0
  9  2  1  0  0  0  0
 10  9  1  0  0  0  0
 11 17  1  0  0  0  0
 12  1  1  0  0  0  0
 13  6  2  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16  8  1  0  0  0  0
 17 13  1  0  0  0  0
 18  3  2  0  0  0  0
 19  8  2  0  0  0  0
 20 16  1  0  0  0  0
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 22  6  1  0  0  0  0
 23  9  2  0  0  0  0
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 25 22  2  0  0  0  0
 26 12  1  0  0  0  0
 27 12  1  0  0  0  0
 28 25  1  0  0  0  0
 29 23  1  0  0  0  0
 30 29  2  0  0  0  0
 28 17  2  0  0  0  0
  4  5  2  0  0  0  0
 24 30  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,174)
2174

>  <Formula> (2,174)
C22H19N3O3S2

>  <MolWeight> (2,174)
437.53456

>  <PCAT_CMPD_ID> (2,174)
WAY-350388

>  <CNC_ID> (2,174)
359438130

>  <transfer_container_id> (2,174)
PTN000000075

>  <COMPOUND_NUMBER> (2,174)
WAY-350388

>  <BAR_CODE_NO> (2,174)
2560666

>  <LOCATION_CODE> (2,174)
PTNCS

>  <AMOUNT_CURRENT> (2,174)
32.8

$$$$
WAY-350418
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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    9.8167   -9.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7625   -9.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7000   -7.2167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5292   -9.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0542   -9.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3500   -5.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3125   -7.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0167  -10.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7875   -8.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7875  -10.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5417   -8.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1917   -5.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1792   -5.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  2  1  0  0  0  0
  9 10  3  0  0  0  0
 10 12  1  0  0  0  0
 11  3  2  0  0  0  0
 12 17  1  0  0  0  0
 13  8  1  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 13  2  0  0  0  0
 19 13  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  2  0  0  0  0
  4  3  1  0  0  0  0
 14 20  2  0  0  0  0
 12 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,175)
2175

>  <Formula> (2,175)
C15H10N2O3S

>  <MolWeight> (2,175)
298.3165

>  <PCAT_CMPD_ID> (2,175)
WAY-350418

>  <CNC_ID> (2,175)
359438160

>  <transfer_container_id> (2,175)
PTN000000075

>  <COMPOUND_NUMBER> (2,175)
WAY-350418

>  <BAR_CODE_NO> (2,175)
2560648

>  <LOCATION_CODE> (2,175)
PTNCS

>  <AMOUNT_CURRENT> (2,175)
32.2

$$$$
WAY-350471
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   10.5792   -8.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7167  -10.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3667   -8.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8792  -10.2542    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.0292   -7.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0667   -8.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2167   -6.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6417  -12.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2917  -10.8292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0000   -1.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4292  -12.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2875   -5.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1042   -7.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0042   -3.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0375    0.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1542   -3.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9750   -5.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9667   -1.7625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5292   -4.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  2  0  0  0  0
 10 14  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  1  0  0  0  0
 14 17  1  0  0  0  0
 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17 13  1  0  0  0  0
 18 10  1  0  0  0  0
 19  5  1  0  0  0  0
 20  6  1  0  0  0  0
  6  4  1  0  0  0  0
 11  8  2  0  0  0  0
 16 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,176)
2176

>  <Formula> (2,176)
C14H18N4OS

>  <MolWeight> (2,176)
290.38392

>  <PCAT_CMPD_ID> (2,176)
WAY-350471

>  <CNC_ID> (2,176)
359438212

>  <transfer_container_id> (2,176)
PTN000000075

>  <COMPOUND_NUMBER> (2,176)
WAY-350471

>  <BAR_CODE_NO> (2,176)
2560755

>  <LOCATION_CODE> (2,176)
PTNCS

>  <AMOUNT_CURRENT> (2,176)
32.2

$$$$
WAY-350547
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   10.9042   -6.0750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0375   -4.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5917   -4.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6042   -6.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8875   -5.8917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9042   -3.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7542   -3.2042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4750   -4.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6167   -3.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6667   -1.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8042   -1.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500   -0.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500   -3.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0167   -0.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0167   -3.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1875   -3.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250   -1.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4542   -7.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3917   -1.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1500   -4.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7000   -3.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1292   -7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  2  0  0  0  0
  9  8  1  0  0  0  0
 10 13  2  0  0  0  0
 11 19  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 11  1  0  0  0  0
 15 11  2  0  0  0  0
 16  7  1  0  0  0  0
 17 10  1  0  0  0  0
 18  4  1  0  0  0  0
 19 16  1  0  0  0  0
 20  8  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23 22  1  0  0  0  0
  6  9  2  0  0  0  0
 20 23  2  0  0  0  0
 10 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,177)
2177

>  <Formula> (2,177)
C19H18N2O2

>  <MolWeight> (2,177)
306.35842

>  <PCAT_CMPD_ID> (2,177)
WAY-350547

>  <CNC_ID> (2,177)
359438283

>  <transfer_container_id> (2,177)
PTN000000075

>  <COMPOUND_NUMBER> (2,177)
WAY-350547

>  <BAR_CODE_NO> (2,177)
2560746

>  <LOCATION_CODE> (2,177)
PTNCS

>  <AMOUNT_CURRENT> (2,177)
32.9

$$$$
WAY-350598
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   13.5042  -12.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1375  -13.5792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.8917  -12.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9000  -13.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4917   -7.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8125   -8.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4417  -10.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8375  -10.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9125  -14.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8667   -6.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7792   -9.5375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4500   -9.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7042  -11.9542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8292   -7.2167    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    6.8625   -7.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2375  -15.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2667  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  2  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  8  1  1  0  0  0  0
  9  4  2  0  0  0  0
 10  5  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  2  0  0  0  0
 14  6  1  0  0  0  0
 15 17  1  0  0  0  0
 16  5  1  0  0  0  0
 17 14  2  0  0  0  0
 18 15  1  0  0  0  0
 19  4  1  0  0  0  0
 20  9  1  0  0  0  0
 21 19  2  0  0  0  0
 22 21  1  0  0  0  0
  9  2  1  0  0  0  0
 20 22  2  0  0  0  0
 10 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,178)
2178

>  <Formula> (2,178)
C17H14Cl2N2O

>  <MolWeight> (2,178)
333.21186

>  <PCAT_CMPD_ID> (2,178)
WAY-350598

>  <CNC_ID> (2,178)
359438333

>  <transfer_container_id> (2,178)
PTN000000075

>  <COMPOUND_NUMBER> (2,178)
WAY-350598

>  <BAR_CODE_NO> (2,178)
2560851

>  <LOCATION_CODE> (2,178)
PTNCS

>  <AMOUNT_CURRENT> (2,178)
29.6

$$$$
WAY-350677
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   10.4792   -6.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4167   -4.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5292   -4.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8125   -4.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7375   -3.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7000   -6.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4417   -3.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7667   -4.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8875   -3.0375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8875   -7.5375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7417   -5.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8167   -5.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9000   -5.2500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3792   -6.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.3625    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.5917   -3.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  8  1  0  0  0  0
  3  4  1  0  0  0  0
  4  7  2  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8 17  1  0  0  0  0
  9 15  1  0  0  0  0
 10  1  2  0  0  0  0
 11  2  2  0  0  0  0
 12  1  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  2  0  0  0  0
 15 18  2  0  0  0  0
 16  3  1  0  0  0  0
 17 12  1  0  0  0  0
 18  7  1  0  0  0  0
 19 20  2  0  0  0  0
 20 14  1  0  0  0  0
 21 13  2  0  0  0  0
 22 19  1  0  0  0  0
 23  9  1  0  0  0  0
 19 21  1  0  0  0  0
  3  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,179)
2179

>  <Formula> (2,179)
C17H16ClFN2O2

>  <MolWeight> (2,179)
334.7725432

>  <PCAT_CMPD_ID> (2,179)
WAY-350677

>  <CNC_ID> (2,179)
359438411

>  <transfer_container_id> (2,179)
PTN000000075

>  <COMPOUND_NUMBER> (2,179)
WAY-350677

>  <BAR_CODE_NO> (2,179)
2560930

>  <LOCATION_CODE> (2,179)
PTNCS

>  <AMOUNT_CURRENT> (2,179)
32.5

$$$$
WAY-350725
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   11.4625   -5.4917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8667   -4.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1625   -5.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8292   -3.4875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7667   -4.2500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.2167   -6.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5167   -6.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2875   -7.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5792   -7.4625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4792   -4.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1167   -3.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8875   -8.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0417   -5.2250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9417   -9.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8167   -3.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  5  1  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13 14  1  0  0  0  0
 14 21  2  0  0  0  0
 15  8  2  0  0  0  0
 16  7  2  0  0  0  0
 17  9  1  0  0  0  0
 18 15  1  0  0  0  0
 19 10  1  0  0  0  0
 20 10  2  0  0  0  0
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 23  5  1  0  0  0  0
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 25 13  1  0  0  0  0
 26 13  1  0  0  0  0
  5  4  1  0  0  0  0
 18 17  2  0  0  0  0
 14 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,180)
2180

>  <Formula> (2,180)
C20H23N3O3

>  <MolWeight> (2,180)
353.41492

>  <PCAT_CMPD_ID> (2,180)
WAY-350725

>  <CNC_ID> (2,180)
359438456

>  <transfer_container_id> (2,180)
PTN000000075

>  <COMPOUND_NUMBER> (2,180)
WAY-350725

>  <BAR_CODE_NO> (2,180)
2561035

>  <LOCATION_CODE> (2,180)
PTNCS

>  <AMOUNT_CURRENT> (2,180)
27.2

$$$$
WAY-350726
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    7.7417   -6.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -11.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 11  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  1  1  0  0  0  0
  8  1  2  0  0  0  0
  9  2  1  0  0  0  0
 10  2  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  6  1  0  0  0  0
 14  4  2  0  0  0  0
 15 13  2  0  0  0  0
 16 15  1  0  0  0  0
 17 19  2  0  0  0  0
 18  7  2  0  0  0  0
 19  8  1  0  0  0  0
 20 13  1  0  0  0  0
 21 15  1  0  0  0  0
 22 20  2  0  0  0  0
 23 22  1  0  0  0  0
 18 17  1  0  0  0  0
 12  3  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,181)
2181

>  <Formula> (2,181)
C17H17ClN4O

>  <MolWeight> (2,181)
328.79608

>  <PCAT_CMPD_ID> (2,181)
WAY-350726

>  <CNC_ID> (2,181)
359438457

>  <transfer_container_id> (2,181)
PTN000000075

>  <COMPOUND_NUMBER> (2,181)
WAY-350726

>  <BAR_CODE_NO> (2,181)
2561036

>  <LOCATION_CODE> (2,181)
PTNCS

>  <AMOUNT_CURRENT> (2,181)
29.4

$$$$
WAY-350916
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
   -1.2291   -4.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
  8  9  2  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,182)
2182

>  <Formula> (2,182)
C15H19ClN2O2

>  <MolWeight> (2,182)
294.77656

>  <PCAT_CMPD_ID> (2,182)
WAY-350916

>  <CNC_ID> (2,182)
359438637

>  <transfer_container_id> (2,182)
PTN000000075

>  <COMPOUND_NUMBER> (2,182)
WAY-350916

>  <BAR_CODE_NO> (2,182)
2561400

>  <LOCATION_CODE> (2,182)
PTNCS

>  <AMOUNT_CURRENT> (2,182)
32.3

$$$$
WAY-350920
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   13.2125  -10.4667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  3  2  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  2  1  0  0  0  0
 12 16  2  0  0  0  0
 13  9  1  0  0  0  0
 14 11  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 13  1  0  0  0  0
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 19  4  2  0  0  0  0
 20  5  2  0  0  0  0
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 22 21  2  0  0  0  0
  5  3  1  0  0  0  0
 22 20  1  0  0  0  0
 12 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,183)
2183

>  <Formula> (2,183)
C17H13N3OS

>  <MolWeight> (2,183)
307.36962

>  <PCAT_CMPD_ID> (2,183)
WAY-350920

>  <CNC_ID> (2,183)
359438641

>  <transfer_container_id> (2,183)
PTN000000075

>  <COMPOUND_NUMBER> (2,183)
WAY-350920

>  <BAR_CODE_NO> (2,183)
2561404

>  <LOCATION_CODE> (2,183)
PTNCS

>  <AMOUNT_CURRENT> (2,183)
32.3

$$$$
WAY-350926
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  9  1  0  0  0  0
 14  7  1  0  0  0  0
 15 20  2  0  0  0  0
 16 10  1  0  0  0  0
 17  2  1  0  0  0  0
 18  3  2  0  0  0  0
 19  7  2  0  0  0  0
 20 19  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 23  5  1  0  0  0  0
 24  5  1  0  0  0  0
 25 17  1  0  0  0  0
 16 22  2  0  0  0  0
 15  9  1  0  0  0  0
  4  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,184)
2184

>  <Formula> (2,184)
C17H17N3O3S2

>  <MolWeight> (2,184)
375.46518

>  <PCAT_CMPD_ID> (2,184)
WAY-350926

>  <CNC_ID> (2,184)
359438647

>  <transfer_container_id> (2,184)
PTN000000075

>  <COMPOUND_NUMBER> (2,184)
WAY-350926

>  <BAR_CODE_NO> (2,184)
2561178

>  <LOCATION_CODE> (2,184)
PTNCS

>  <AMOUNT_CURRENT> (2,184)
29.4

$$$$
WAY-350930
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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   -0.9458   -1.9375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -5.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5000   -1.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7333   -3.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  3  1  0  0  0  0
  8  6  2  0  0  0  0
  9  7  2  0  0  0  0
 10  6  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  1  0  0  0  0
 13 16  1  0  0  0  0
 14 22  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 14  2  0  0  0  0
 18 14  1  0  0  0  0
 19 10  1  0  0  0  0
 20 13  1  0  0  0  0
 21  7  1  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
  5  3  2  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,185)
2185

>  <Formula> (2,185)
C18H22N2O3

>  <MolWeight> (2,185)
314.37888

>  <PCAT_CMPD_ID> (2,185)
WAY-350930

>  <CNC_ID> (2,185)
359438651

>  <transfer_container_id> (2,185)
PTN000000075

>  <COMPOUND_NUMBER> (2,185)
WAY-350930

>  <BAR_CODE_NO> (2,185)
2561182

>  <LOCATION_CODE> (2,185)
PTNCS

>  <AMOUNT_CURRENT> (2,185)
32.6

$$$$
WAY-350968
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    5.9292   -9.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.1542  -11.0792    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   11.0792  -12.4500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5125   -9.4792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -12.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  4  1  0  0  0  0
  8  6  1  0  0  0  0
  9  2  1  0  0  0  0
 10 12  1  0  0  0  0
 11  8  1  0  0  0  0
 12  6  1  0  0  0  0
 13 10  1  0  0  0  0
 14  5  2  0  0  0  0
 15  9  1  0  0  0  0
 16 11  2  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19 16  1  0  0  0  0
 20 17  1  0  0  0  0
  7  9  2  0  0  0  0
 13 11  1  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,186)
2186

>  <Formula> (2,186)
C13H13N3O3S

>  <MolWeight> (2,186)
291.32562

>  <PCAT_CMPD_ID> (2,186)
WAY-350968

>  <CNC_ID> (2,186)
359438685

>  <transfer_container_id> (2,186)
PTN000000075

>  <COMPOUND_NUMBER> (2,186)
WAY-350968

>  <BAR_CODE_NO> (2,186)
2561258

>  <LOCATION_CODE> (2,186)
PTNCS

>  <AMOUNT_CURRENT> (2,186)
32.8

$$$$
WAY-351044
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    7.7542    3.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7125    4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5375    4.8125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.4000    3.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.4417    1.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3042    0.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1375    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0917    1.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000    4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   11.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8917   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  9  2  0  0  0  0
  7  3  1  0  0  0  0
  8 17  1  0  0  0  0
  9  5  1  0  0  0  0
 10  8  1  0  0  0  0
 11 10  2  0  0  0  0
 12  2  2  0  0  0  0
 13  3  2  0  0  0  0
 14  7  1  0  0  0  0
 15  7  1  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18  6  1  0  0  0  0
 19 18  1  0  0  0  0
 20  9  1  0  0  0  0
 21 10  1  0  0  0  0
 22 20  2  0  0  0  0
 23 11  1  0  0  0  0
 24 22  1  0  0  0  0
 25 19  1  0  0  0  0
 26 21  2  0  0  0  0
 27 26  1  0  0  0  0
  6  4  1  0  0  0  0
  8 16  1  0  0  0  0
 18 24  2  0  0  0  0
 23 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,187)
2187

>  <Formula> (2,187)
C20H19N3O4

>  <MolWeight> (2,187)
365.38256

>  <PCAT_CMPD_ID> (2,187)
WAY-351044

>  <CNC_ID> (2,187)
359438758

>  <transfer_container_id> (2,187)
PTN000000075

>  <COMPOUND_NUMBER> (2,187)
WAY-351044

>  <BAR_CODE_NO> (2,187)
2563294

>  <LOCATION_CODE> (2,187)
PTNCS

>  <AMOUNT_CURRENT> (2,187)
32.8

$$$$
WAY-351103
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    6.7417   -8.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6292  -12.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  7  1  0  0  0  0
  4  3  2  0  0  0  0
  5  2  2  0  0  0  0
  6  8  2  0  0  0  0
  7 15  1  0  0  0  0
  8  1  1  0  0  0  0
  9  3  1  0  0  0  0
 10  9  2  0  0  0  0
 11  4  1  0  0  0  0
 12  1  1  0  0  0  0
 13 10  1  0  0  0  0
 14  2  1  0  0  0  0
 15 17  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18 12  2  0  0  0  0
 19 12  1  0  0  0  0
 20  9  1  0  0  0  0
 21 13  1  0  0  0  0
 22 23  1  0  0  0  0
 23 19  2  0  0  0  0
 24 18  1  0  0  0  0
 25 22  1  0  0  0  0
 26 11  1  0  0  0  0
 27 25  1  0  0  0  0
  6  5  1  0  0  0  0
 22 24  2  0  0  0  0
 11 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,188)
2188

>  <Formula> (2,188)
C17H15Cl2N5O2S

>  <MolWeight> (2,188)
424.3043

>  <PCAT_CMPD_ID> (2,188)
WAY-351103

>  <CNC_ID> (2,188)
359438813

>  <transfer_container_id> (2,188)
PTN000000075

>  <COMPOUND_NUMBER> (2,188)
WAY-351103

>  <BAR_CODE_NO> (2,188)
2561275

>  <LOCATION_CODE> (2,188)
PTNCS

>  <AMOUNT_CURRENT> (2,188)
32.2

$$$$
WAY-351140
csChFnd80/10111816222D

 27 28  0  0  0  0  0  0  0  0999 V2000
   13.8875  -12.7292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0167  -14.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0625  -11.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4083   -4.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3625    0.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8 11  2  0  0  0  0
  9  4  2  0  0  0  0
 10 16  1  0  0  0  0
 11 10  1  0  0  0  0
 12  6  2  0  0  0  0
 13  3  1  0  0  0  0
 14  8  1  0  0  0  0
 15  7  1  0  0  0  0
 16 15  1  0  0  0  0
 17  7  2  0  0  0  0
 18 10  2  0  0  0  0
 19  1  1  0  0  0  0
 20  2  1  0  0  0  0
 21 14  2  0  0  0  0
 22 21  1  0  0  0  0
 23 14  1  0  0  0  0
 24 21  1  0  0  0  0
 25 22  1  0  0  0  0
 26 27  1  0  0  0  0
 27 23  2  0  0  0  0
  5  6  1  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,189)
2189

>  <Formula> (2,189)
C18H19N3O6

>  <MolWeight> (2,189)
373.35996

>  <PCAT_CMPD_ID> (2,189)
WAY-351140

>  <CNC_ID> (2,189)
359438849

>  <transfer_container_id> (2,189)
PTN000000075

>  <COMPOUND_NUMBER> (2,189)
WAY-351140

>  <BAR_CODE_NO> (2,189)
2561393

>  <LOCATION_CODE> (2,189)
PTNCS

>  <AMOUNT_CURRENT> (2,189)
32.7

$$$$
WAY-351142
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   14.7917   -8.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9417   -9.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   13.0042   -5.2917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3042  -10.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  2  1  0  0  0  0
  7 10  1  0  0  0  0
  8  7  1  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 11 10  2  0  0  0  0
 12  5  1  0  0  0  0
 13 18  1  0  0  0  0
 14  4  2  0  0  0  0
 15  6  2  0  0  0  0
 16  3  1  0  0  0  0
 17  8  1  0  0  0  0
 18 12  1  0  0  0  0
 19 12  2  0  0  0  0
 20  1  1  0  0  0  0
 21  2  1  0  0  0  0
 22  7  1  0  0  0  0
 23 17  1  0  0  0  0
 24 17  2  0  0  0  0
 25 24  1  0  0  0  0
 26 23  2  0  0  0  0
 27 25  2  0  0  0  0
  5  6  1  0  0  0  0
  9  8  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,190)
2190

>  <Formula> (2,190)
C17H18N6O3S

>  <MolWeight> (2,190)
386.42822

>  <PCAT_CMPD_ID> (2,190)
WAY-351142

>  <CNC_ID> (2,190)
359438851

>  <transfer_container_id> (2,190)
PTN000000075

>  <COMPOUND_NUMBER> (2,190)
WAY-351142

>  <BAR_CODE_NO> (2,190)
2561395

>  <LOCATION_CODE> (2,190)
PTNCS

>  <AMOUNT_CURRENT> (2,190)
29

$$$$
WAY-351145
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3 12  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  2  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  6  2  0  0  0  0
  9  3  1  0  0  0  0
 10  9  2  0  0  0  0
 11  2  1  0  0  0  0
 12 14  1  0  0  0  0
 13  6  1  0  0  0  0
 14 13  1  0  0  0  0
 15 11  2  0  0  0  0
 16 12  2  0  0  0  0
 17  1  1  0  0  0  0
 18 19  1  0  0  0  0
 19  7  1  0  0  0  0
 20 18  2  0  0  0  0
 21  5  1  0  0  0  0
 22 10  1  0  0  0  0
 23 11  1  0  0  0  0
 24 15  1  0  0  0  0
 25 15  1  0  0  0  0
 26 23  2  0  0  0  0
 27 26  1  0  0  0  0
  8  4  1  0  0  0  0
 27 25  2  0  0  0  0
 10  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,191)
2191

>  <Formula> (2,191)
C21H24N4OS

>  <MolWeight> (2,191)
380.50646

>  <PCAT_CMPD_ID> (2,191)
WAY-351145

>  <CNC_ID> (2,191)
359438854

>  <transfer_container_id> (2,191)
PTN000000075

>  <COMPOUND_NUMBER> (2,191)
WAY-351145

>  <BAR_CODE_NO> (2,191)
2561398

>  <LOCATION_CODE> (2,191)
PTNCS

>  <AMOUNT_CURRENT> (2,191)
32.7

$$$$
WAY-351208
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    9.9042   -4.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4375   -5.4042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  6  2  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  7  1  0  0  0  0
  9  5  1  0  0  0  0
 10  8  1  0  0  0  0
 11 10  2  0  0  0  0
 12 15  1  0  0  0  0
 13  5  2  0  0  0  0
 14  3  1  0  0  0  0
 15 20  1  0  0  0  0
 16  8  2  0  0  0  0
 17  9  1  0  0  0  0
 18 24  2  0  0  0  0
 19 10  1  0  0  0  0
 20 28  2  0  0  0  0
 21 12  1  0  0  0  0
 22 12  1  0  0  0  0
 23  6  1  0  0  0  0
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 25 18  1  0  0  0  0
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 27 17  2  0  0  0  0
 28 27  1  0  0  0  0
 29 26  2  0  0  0  0
  2  4  1  0  0  0  0
 20 29  1  0  0  0  0
 18 11  1  0  0  0  0
M  END
>  <Mol_ID> (2,192)
2192

>  <Formula> (2,192)
C19H14Cl3F2N3O2

>  <MolWeight> (2,192)
460.6891664

>  <PCAT_CMPD_ID> (2,192)
WAY-351208

>  <CNC_ID> (2,192)
359438912

>  <transfer_container_id> (2,192)
PTN000000075

>  <COMPOUND_NUMBER> (2,192)
WAY-351208

>  <BAR_CODE_NO> (2,192)
2561423

>  <LOCATION_CODE> (2,192)
PTNCS

>  <AMOUNT_CURRENT> (2,192)
32.8

$$$$
WAY-351220
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   12.7375   -5.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
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  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  9  2  0  0  0  0
  9  1  1  0  0  0  0
 10  3  1  0  0  0  0
 11 14  1  0  0  0  0
 12 19  1  0  0  0  0
 13 15  1  0  0  0  0
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 17 10  1  0  0  0  0
 18 11  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
  6  8  1  0  0  0  0
  7  4  2  0  0  0  0
 11 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,193)
2193

>  <Formula> (2,193)
C15H15N3OS

>  <MolWeight> (2,193)
285.3641

>  <PCAT_CMPD_ID> (2,193)
WAY-351220

>  <CNC_ID> (2,193)
359438923

>  <transfer_container_id> (2,193)
PTN000000075

>  <COMPOUND_NUMBER> (2,193)
WAY-351220

>  <BAR_CODE_NO> (2,193)
2561433

>  <LOCATION_CODE> (2,193)
PTNCS

>  <AMOUNT_CURRENT> (2,193)
32.7

$$$$
WAY-351367
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 12  5  1  0  0  0  0
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 20  1  1  0  0  0  0
 21  2  1  0  0  0  0
 22 14  2  0  0  0  0
 23 14  1  0  0  0  0
 24  7  1  0  0  0  0
 25 27  1  0  0  0  0
 26 22  1  0  0  0  0
 27 23  2  0  0  0  0
 28 25  1  0  0  0  0
  5  6  1  0  0  0  0
  9  8  2  0  0  0  0
 26 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,194)
2194

>  <Formula> (2,194)
C17H17FN6O3S

>  <MolWeight> (2,194)
404.4186832

>  <PCAT_CMPD_ID> (2,194)
WAY-351367

>  <CNC_ID> (2,194)
359439064

>  <transfer_container_id> (2,194)
PTN000000075

>  <COMPOUND_NUMBER> (2,194)
WAY-351367

>  <BAR_CODE_NO> (2,194)
2561609

>  <LOCATION_CODE> (2,194)
PTNCS

>  <AMOUNT_CURRENT> (2,194)
32.7

$$$$
WAY-351475
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   13.8792  -11.0792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1292   -9.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8417  -10.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8042  -10.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3292   -9.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5542   -6.3750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6667   -8.4917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2250   -7.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9167  -12.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8750  -14.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3292   -6.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4417   -8.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3375   -8.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7750   -7.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9167  -14.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8792  -12.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4417   -7.3417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.1125   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8917   -7.2292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2167  -13.7917    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.8292  -15.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.5292  -15.8875    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -9.6542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6542   -5.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7042  -10.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9917  -12.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0000  -14.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0375  -14.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  8  2  0  0  0  0
  7  8  1  0  0  0  0
  8 17  1  0  0  0  0
  9  1  1  0  0  0  0
 10 15  1  0  0  0  0
 11  6  1  0  0  0  0
 12  7  2  0  0  0  0
 13  2  1  0  0  0  0
 14 12  1  0  0  0  0
 15 16  1  0  0  0  0
 16  9  2  0  0  0  0
 17 18  1  0  0  0  0
 18 13  1  0  0  0  0
 19 13  2  0  0  0  0
 20 10  1  0  0  0  0
 21 10  1  0  0  0  0
 22 10  1  0  0  0  0
 23 12  1  0  0  0  0
 24 11  1  0  0  0  0
 25  3  1  0  0  0  0
 26  4  1  0  0  0  0
 27  9  1  0  0  0  0
 28 29  1  0  0  0  0
 29 27  2  0  0  0  0
  5  2  1  0  0  0  0
 15 28  2  0  0  0  0
 14 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,195)
2195

>  <Formula> (2,195)
C19H18F3N5OS

>  <MolWeight> (2,195)
421.4393296

>  <PCAT_CMPD_ID> (2,195)
WAY-351475

>  <CNC_ID> (2,195)
359439169

>  <transfer_container_id> (2,195)
PTN000000075

>  <COMPOUND_NUMBER> (2,195)
WAY-351475

>  <BAR_CODE_NO> (2,195)
2561740

>  <LOCATION_CODE> (2,195)
PTNCS

>  <AMOUNT_CURRENT> (2,195)
29.4

$$$$
WAY-351489
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   14.0542  -12.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4375  -11.1792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.8167  -10.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9542   -9.0875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7375   -7.0500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.3375  -12.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4750  -13.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9292   -6.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6000  -10.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3917   -9.0917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3292   -4.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -13.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7667   -9.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5375   -8.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1625   -8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9250   -7.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1292  -14.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292   -6.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4125  -14.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1375   -4.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9042  -11.0917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5792  -15.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5500   -6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5375   -3.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0750   -9.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3625   -6.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3542   -3.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7542   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  9  1  0  0  0  0
  5 16  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  1  0  0  0  0
  8 18  1  0  0  0  0
  9  3  1  0  0  0  0
 10  3  2  0  0  0  0
 11  8  2  0  0  0  0
 12  6  1  0  0  0  0
 13  4  1  0  0  0  0
 14  4  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 17  7  2  0  0  0  0
 18  5  1  0  0  0  0
 19 17  1  0  0  0  0
 20 11  1  0  0  0  0
 21  6  1  0  0  0  0
 22 17  1  0  0  0  0
 23 20  2  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 26 23  1  0  0  0  0
 27 24  2  0  0  0  0
 28 27  1  0  0  0  0
 12 19  2  0  0  0  0
 15  5  1  0  0  0  0
 28 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,196)
2196

>  <Formula> (2,196)
C23H29N3O2

>  <MolWeight> (2,196)
379.49526

>  <PCAT_CMPD_ID> (2,196)
WAY-351489

>  <CNC_ID> (2,196)
359439183

>  <transfer_container_id> (2,196)
PTN000000075

>  <COMPOUND_NUMBER> (2,196)
WAY-351489

>  <BAR_CODE_NO> (2,196)
2561797

>  <LOCATION_CODE> (2,196)
PTNCS

>  <AMOUNT_CURRENT> (2,196)
32.9

$$$$
WAY-351603
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
    6.3125   -5.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8000   -6.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8167   -7.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7167   -7.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4417   -5.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -4.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3417   -5.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8917   -4.9667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.3750   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8542   -4.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5417   -5.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1792   -8.7417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9125   -6.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1792   -6.8542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2792   -7.6875    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.7000   -7.3000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8917   -6.2625    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000   -4.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0875   -6.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3292   -4.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7500   -4.9792    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.8292   -9.7042    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.3625   -6.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4625   -8.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4500   -6.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4 14  1  0  0  0  0
  5  8  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  1  0  0  0  0
  8 10  1  0  0  0  0
  9  3  1  0  0  0  0
 10  7  2  0  0  0  0
 11  5  1  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
 14 19  1  0  0  0  0
 15  2  1  0  0  0  0
 16  2  1  0  0  0  0
 17  2  1  0  0  0  0
 18  6  1  0  0  0  0
 19 11  1  0  0  0  0
 20 10  1  0  0  0  0
 21  6  1  0  0  0  0
 22  9  1  0  0  0  0
 23  3  2  0  0  0  0
 24  9  2  0  0  0  0
 25 23  1  0  0  0  0
 26 25  2  0  0  0  0
 20 18  2  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,197)
2197

>  <Formula> (2,197)
C17H13Cl2F3N2O2

>  <MolWeight> (2,197)
405.1985296

>  <PCAT_CMPD_ID> (2,197)
WAY-351603

>  <CNC_ID> (2,197)
359439296

>  <transfer_container_id> (2,197)
PTN000000075

>  <COMPOUND_NUMBER> (2,197)
WAY-351603

>  <BAR_CODE_NO> (2,197)
2561853

>  <LOCATION_CODE> (2,197)
PTNCS

>  <AMOUNT_CURRENT> (2,197)
32.1

$$$$
WAY-351611
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    5.7139    8.1325    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139    7.3107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4232    6.9039    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4232    8.5476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1325    8.1325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1324    7.3097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9150    7.0553    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3987    7.7210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9151    8.3867    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4154    9.3694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.9039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4228    6.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0010    8.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1690    9.1683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9729    9.3391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2269   10.1207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6822    7.6593    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5040    7.6593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7598    8.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0931    8.9253    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.4306    8.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9863    6.9939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6489    8.6940    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6480    6.2452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1296    5.5802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9479    5.6648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2824    6.4201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7988    7.0820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4311    5.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.1023    6.4225    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  1  0  0  0  0
  2  3  1  0  0  0  0
  3  6  1  0  0  0  0
  5  4  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  4 10  2  0  0  0  0
  2 11  2  0  0  0  0
  3 12  1  0  0  0  0
  1 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 17  2  0  0  0  0
 18 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 22  1  0  0  0  0
 26 29  1  0  0  0  0
 15 23  1  0  0  0  0
 27 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,198)
2198

>  <Formula> (2,198)
C18H14Cl2N6O3S

>  <MolWeight> (2,198)
465.31316

>  <PCAT_CMPD_ID> (2,198)
WAY-351611

>  <CNC_ID> (2,198)
359439304

>  <transfer_container_id> (2,198)
PTN000000075

>  <COMPOUND_NUMBER> (2,198)
WAY-351611

>  <BAR_CODE_NO> (2,198)
2561955

>  <LOCATION_CODE> (2,198)
PTNCS

>  <AMOUNT_CURRENT> (2,198)
32.7

$$$$
WAY-351616
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   13.9375  -10.0917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.0417   -5.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2417   -8.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6667   -5.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  2  1  0  0  0  0
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  6  2  1  0  0  0  0
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  8  1  1  0  0  0  0
  9 15  1  0  0  0  0
 10  9  1  0  0  0  0
 11  3  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  6  1  0  0  0  0
 15 17  1  0  0  0  0
 16  3  1  0  0  0  0
 17 11  1  0  0  0  0
 18  4  2  0  0  0  0
 19  9  2  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
 22  6  2  0  0  0  0
 23  8  1  0  0  0  0
 24  8  1  0  0  0  0
 25 14  2  0  0  0  0
 26 16  1  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
 17 21  2  0  0  0  0
  5  7  2  0  0  0  0
 25 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,199)
2199

>  <Formula> (2,199)
C19H20N4O4S

>  <MolWeight> (2,199)
400.4515

>  <PCAT_CMPD_ID> (2,199)
WAY-351616

>  <CNC_ID> (2,199)
359439309

>  <transfer_container_id> (2,199)
PTN000000075

>  <COMPOUND_NUMBER> (2,199)
WAY-351616

>  <BAR_CODE_NO> (2,199)
2561962

>  <LOCATION_CODE> (2,199)
PTNCS

>  <AMOUNT_CURRENT> (2,199)
32.5

$$$$
WAY-351693
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.1167   -3.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7250   -1.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7 10  1  0  0  0  0
  8  7  1  0  0  0  0
  9 18  1  0  0  0  0
 10  5  1  0  0  0  0
 11  9  1  0  0  0  0
 12  4  1  0  0  0  0
 13  7  2  0  0  0  0
 14  9  2  0  0  0  0
 15 11  1  0  0  0  0
 16 14  1  0  0  0  0
 17  6  1  0  0  0  0
 18  8  1  0  0  0  0
 19 12  2  0  0  0  0
 20 17  2  0  0  0  0
 21 10  1  0  0  0  0
 22 19  1  0  0  0  0
  4  6  2  0  0  0  0
 19 20  1  0  0  0  0
 16 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,200)
2200

>  <Formula> (2,200)
C16H17N3O2S

>  <MolWeight> (2,200)
315.39008

>  <PCAT_CMPD_ID> (2,200)
WAY-351693

>  <CNC_ID> (2,200)
359439382

>  <transfer_container_id> (2,200)
PTN000000075

>  <COMPOUND_NUMBER> (2,200)
WAY-351693

>  <BAR_CODE_NO> (2,200)
2561989

>  <LOCATION_CODE> (2,200)
PTNCS

>  <AMOUNT_CURRENT> (2,200)
29.7

$$$$
WAY-351711
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
   11.3417  -11.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0125  -12.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -12.7000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7 15  2  0  0  0  0
  8  6  1  0  0  0  0
  9 17  2  0  0  0  0
 10  7  1  0  0  0  0
 11  4  2  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14  6  2  0  0  0  0
 15 19  1  0  0  0  0
 16  5  2  0  0  0  0
 17 23  1  0  0  0  0
 18 11  1  0  0  0  0
 19 20  1  0  0  0  0
 20  8  1  0  0  0  0
 21  2  1  0  0  0  0
 22 16  1  0  0  0  0
 23 19  2  0  0  0  0
 24 18  1  0  0  0  0
  4  5  1  0  0  0  0
 18 22  2  0  0  0  0
  9  7  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,201)
2201

>  <Formula> (2,201)
C18H14BrNO4

>  <MolWeight> (2,201)
388.21206

>  <PCAT_CMPD_ID> (2,201)
WAY-351711

>  <CNC_ID> (2,201)
359439400

>  <transfer_container_id> (2,201)
PTN000000075

>  <COMPOUND_NUMBER> (2,201)
WAY-351711

>  <BAR_CODE_NO> (2,201)
2561936

>  <LOCATION_CODE> (2,201)
PTNCS

>  <AMOUNT_CURRENT> (2,201)
32.6

$$$$
WAY-351766
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
   10.6667   -4.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
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  7  8  1  0  0  0  0
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 10 12  1  0  0  0  0
 11 10  1  0  0  0  0
 12  1  1  0  0  0  0
 13  6  2  0  0  0  0
 14  6  1  0  0  0  0
 15  7  1  0  0  0  0
 16 13  1  0  0  0  0
 17 14  2  0  0  0  0
 18  7  2  0  0  0  0
 19 10  2  0  0  0  0
 20 17  1  0  0  0  0
 21 15  2  0  0  0  0
 22 15  1  0  0  0  0
 23 22  2  0  0  0  0
 24 21  1  0  0  0  0
 25 23  1  0  0  0  0
 26  4  2  0  0  0  0
 27  5  2  0  0  0  0
 28 14  1  0  0  0  0
 29 13  1  0  0  0  0
 30  9  1  0  0  0  0
 31 20  1  0  0  0  0
 32 25  1  0  0  0  0
 33 26  1  0  0  0  0
 34 33  2  0  0  0  0
  5  3  1  0  0  0  0
 27 34  1  0  0  0  0
 16 20  2  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,202)
2202

>  <Formula> (2,202)
C28H30N4O2

>  <MolWeight> (2,202)
454.5634

>  <PCAT_CMPD_ID> (2,202)
WAY-351766

>  <CNC_ID> (2,202)
359439453

>  <transfer_container_id> (2,202)
PTN000000075

>  <COMPOUND_NUMBER> (2,202)
WAY-351766

>  <BAR_CODE_NO> (2,202)
2562077

>  <LOCATION_CODE> (2,202)
PTNCS

>  <AMOUNT_CURRENT> (2,202)
32.9

$$$$
WAY-351847
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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   -0.1375   -1.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  1  1  0  0  0  0
  9  6  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  4  2  0  0  0  0
 13  7  1  0  0  0  0
 14  9  1  0  0  0  0
 15  8  2  0  0  0  0
 16  8  1  0  0  0  0
 17  2  1  0  0  0  0
 18  3  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
 22 17  1  0  0  0  0
 23 21  1  0  0  0  0
 22 18  1  0  0  0  0
 21 19  2  0  0  0  0
 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,203)
2203

>  <Formula> (2,203)
C15H17N3O3S2

>  <MolWeight> (2,203)
351.44378

>  <PCAT_CMPD_ID> (2,203)
WAY-351847

>  <CNC_ID> (2,203)
359439533

>  <transfer_container_id> (2,203)
PTN000000075

>  <COMPOUND_NUMBER> (2,203)
WAY-351847

>  <BAR_CODE_NO> (2,203)
2562135

>  <LOCATION_CODE> (2,203)
PTNCS

>  <AMOUNT_CURRENT> (2,203)
33

$$$$
WAY-351873
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.0292   -4.7167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4667   -3.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6542   -6.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5292   -7.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7917  -10.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.4042   -9.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5250  -10.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5167   -4.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9250    1.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.1167  -12.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4  3  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  3  0  0  0  0
  7 12  1  0  0  0  0
  8  2  1  0  0  0  0
  9  8  2  0  0  0  0
 10  4  1  0  0  0  0
 11 13  2  0  0  0  0
 12 10  2  0  0  0  0
 13  5  1  0  0  0  0
 14  1  1  0  0  0  0
 15  1  1  0  0  0  0
 16  3  2  0  0  0  0
 17 18  1  0  0  0  0
 18  1  1  0  0  0  0
 19 11  1  0  0  0  0
 20  9  1  0  0  0  0
 21 12  1  0  0  0  0
 22 10  1  0  0  0  0
 23 20  1  0  0  0  0
 24 19  1  0  0  0  0
 25 26  1  0  0  0  0
 26 22  2  0  0  0  0
  5  2  2  0  0  0  0
 11  9  1  0  0  0  0
 25 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,204)
2204

>  <Formula> (2,204)
C20H21N3O3

>  <MolWeight> (2,204)
351.39904

>  <PCAT_CMPD_ID> (2,204)
WAY-351873

>  <CNC_ID> (2,204)
359439558

>  <transfer_container_id> (2,204)
PTN000000075

>  <COMPOUND_NUMBER> (2,204)
WAY-351873

>  <BAR_CODE_NO> (2,204)
2562104

>  <LOCATION_CODE> (2,204)
PTNCS

>  <AMOUNT_CURRENT> (2,204)
33

$$$$
WAY-351925
csChFnd80/10111816222D

 10 10  0  0  0  0  0  0  0  0999 V2000
    6.5250   -7.1542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8500   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1875   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.9375   -5.8875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6667   -6.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6250   -5.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  1  0  0  0  0
  5  4  1  0  0  0  0
M  END
>  <Mol_ID> (2,205)
2205

>  <Formula> (2,205)
C5H9N3OS

>  <MolWeight> (2,205)
159.20946

>  <PCAT_CMPD_ID> (2,205)
WAY-351925

>  <CNC_ID> (2,205)
359439613

>  <transfer_container_id> (2,205)
PTN000000075

>  <COMPOUND_NUMBER> (2,205)
WAY-351925

>  <BAR_CODE_NO> (2,205)
2562368

>  <LOCATION_CODE> (2,205)
PTNCS

>  <AMOUNT_CURRENT> (2,205)
22.8

$$$$
WAY-351964
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
    7.0375   -4.3167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.0792   -7.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6417   -8.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9542   -7.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6417   -6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4750   -3.3667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6042   -5.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7625   -8.1750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0250   -2.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3917   -6.2542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3167   -7.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1125   -0.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  2  1  0  0  0  0
  4 10  1  0  0  0  0
  5  2  2  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  6  1  0  0  0  0
 10 16  1  0  0  0  0
 11  5  1  0  0  0  0
 12 11  2  0  0  0  0
 13  7  1  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16 13  2  0  0  0  0
 17  3  2  0  0  0  0
 18  7  2  0  0  0  0
 19  4  2  0  0  0  0
 20  9  2  0  0  0  0
 21 18  1  0  0  0  0
 22 21  2  0  0  0  0
 23 20  1  0  0  0  0
 24  9  1  0  0  0  0
 25 11  1  0  0  0  0
 26 12  1  0  0  0  0
 27 18  1  0  0  0  0
 28 20  1  0  0  0  0
 29 23  1  0  0  0  0
 30 24  2  0  0  0  0
 31 25  2  0  0  0  0
 32 31  1  0  0  0  0
 33 30  1  0  0  0  0
 16 22  1  0  0  0  0
 33 28  2  0  0  0  0
 12  8  1  0  0  0  0
 26 32  2  0  0  0  0
M  END
>  <Mol_ID> (2,206)
2206

>  <Formula> (2,206)
C24H20N2O6S

>  <MolWeight> (2,206)
464.4904

>  <PCAT_CMPD_ID> (2,206)
WAY-351964

>  <CNC_ID> (2,206)
359439651

>  <transfer_container_id> (2,206)
PTN000000075

>  <COMPOUND_NUMBER> (2,206)
WAY-351964

>  <BAR_CODE_NO> (2,206)
2562208

>  <LOCATION_CODE> (2,206)
PTNCS

>  <AMOUNT_CURRENT> (2,206)
32.2

$$$$
WAY-352023
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
    9.3917   -8.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7417   -7.6542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4875   -8.5542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0292   -9.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7042  -10.4417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -10.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  4  1  0  0  0  0
  9  2  1  0  0  0  0
 10 13  1  0  0  0  0
 11  7  1  0  0  0  0
 12  8  2  0  0  0  0
 13  6  1  0  0  0  0
 14 10  1  0  0  0  0
 15  5  2  0  0  0  0
 16  9  2  0  0  0  0
 17 12  1  0  0  0  0
 18 16  1  0  0  0  0
 19 17  1  0  0  0  0
 20 11  2  0  0  0  0
 21 14  2  0  0  0  0
 22 19  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
  9  8  1  0  0  0  0
 18 17  2  0  0  0  0
 11 14  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,207)
2207

>  <Formula> (2,207)
C17H14N2O4S

>  <MolWeight> (2,207)
342.36906

>  <PCAT_CMPD_ID> (2,207)
WAY-352023

>  <CNC_ID> (2,207)
359439707

>  <transfer_container_id> (2,207)
PTN000000075

>  <COMPOUND_NUMBER> (2,207)
WAY-352023

>  <BAR_CODE_NO> (2,207)
2562303

>  <LOCATION_CODE> (2,207)
PTNCS

>  <AMOUNT_CURRENT> (2,207)
32.5

$$$$
WAY-352066
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    9.4792   -5.3750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5292   -3.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7 12  2  0  0  0  0
  8  2  2  0  0  0  0
  9  3  2  0  0  0  0
 10  6  1  0  0  0  0
 11 13  2  0  0  0  0
 12 10  1  0  0  0  0
 13 15  1  0  0  0  0
 14  7  1  0  0  0  0
 15 10  2  0  0  0  0
 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
 18 11  1  0  0  0  0
 19 18  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  1  0  0  0  0
 22 20  1  0  0  0  0
  4  5  1  0  0  0  0
  7 11  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,208)
2208

>  <Formula> (2,208)
C16H19FN2O3

>  <MolWeight> (2,208)
306.3320632

>  <PCAT_CMPD_ID> (2,208)
WAY-352066

>  <CNC_ID> (2,208)
359439750

>  <transfer_container_id> (2,208)
PTN000000075

>  <COMPOUND_NUMBER> (2,208)
WAY-352066

>  <BAR_CODE_NO> (2,208)
2562332

>  <LOCATION_CODE> (2,208)
PTNCS

>  <AMOUNT_CURRENT> (2,208)
32.4

$$$$
WAY-352081
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   11.3542  -10.1042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6042   -8.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4417   -7.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7667   -8.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.9292  -10.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4250   -4.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -10.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1625  -11.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  7  2  0  0  0  0
  5 10  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8 18  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 13  1  0  0  0  0
 12  8  2  0  0  0  0
 13 14  2  0  0  0  0
 14 10  1  0  0  0  0
 15  6  1  0  0  0  0
 16 11  1  0  0  0  0
 17  3  1  0  0  0  0
 18 19  1  0  0  0  0
 19 17  1  0  0  0  0
 20  4  1  0  0  0  0
 21  7  1  0  0  0  0
 22 15  1  0  0  0  0
 23 16  1  0  0  0  0
 24 25  1  0  0  0  0
 25 21  2  0  0  0  0
  3  4  1  0  0  0  0
 20 24  2  0  0  0  0
  6 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,209)
2209

>  <Formula> (2,209)
C20H22N2O3

>  <MolWeight> (2,209)
338.40028

>  <PCAT_CMPD_ID> (2,209)
WAY-352081

>  <CNC_ID> (2,209)
359439765

>  <transfer_container_id> (2,209)
PTN000000075

>  <COMPOUND_NUMBER> (2,209)
WAY-352081

>  <BAR_CODE_NO> (2,209)
2562347

>  <LOCATION_CODE> (2,209)
PTNCS

>  <AMOUNT_CURRENT> (2,209)
32.6

$$$$
WAY-352139
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    6.9125   -5.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1417   -5.2292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.4542   -3.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2250   -3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1875   -6.2667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.8292   -7.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6417   -3.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1167   -7.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2500   -2.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  9  1  0  0  0  0
  9  6  2  0  0  0  0
 10  3  1  0  0  0  0
 11 10  1  0  0  0  0
 12  4  1  0  0  0  0
 13 11  1  0  0  0  0
 14 18  2  0  0  0  0
 15 13  1  0  0  0  0
 16 13  2  0  0  0  0
 17 15  2  0  0  0  0
 18 16  1  0  0  0  0
 19  9  1  0  0  0  0
 20 14  1  0  0  0  0
  7  3  2  0  0  0  0
  8  4  2  0  0  0  0
 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,210)
2210

>  <Formula> (2,210)
C15H16N4S

>  <MolWeight> (2,210)
284.37934

>  <PCAT_CMPD_ID> (2,210)
WAY-352139

>  <CNC_ID> (2,210)
359439819

>  <transfer_container_id> (2,210)
PTN000000075

>  <COMPOUND_NUMBER> (2,210)
WAY-352139

>  <BAR_CODE_NO> (2,210)
2562430

>  <LOCATION_CODE> (2,210)
PTNCS

>  <AMOUNT_CURRENT> (2,210)
32.6

$$$$
WAY-352156
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    5.9792   -3.8000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7750   -7.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9250   -7.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 11  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  6  2  2  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  1  0  0  0  0
 11 22  1  0  0  0  0
 12  1  1  0  0  0  0
 13  7  1  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16  3  2  0  0  0  0
 17  7  2  0  0  0  0
 18 13  1  0  0  0  0
 19 17  1  0  0  0  0
 20 10  2  0  0  0  0
 21 10  1  0  0  0  0
 22 24  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  2  0  0  0  0
 25  8  2  0  0  0  0
 26  9  2  0  0  0  0
 27 12  1  0  0  0  0
 28 12  1  0  0  0  0
 29 25  1  0  0  0  0
 30 29  2  0  0  0  0
 22 23  2  0  0  0  0
  5  4  2  0  0  0  0
 30 26  1  0  0  0  0
 19 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,211)
2211

>  <Formula> (2,211)
C22H19N3O3S2

>  <MolWeight> (2,211)
437.53456

>  <PCAT_CMPD_ID> (2,211)
WAY-352156

>  <CNC_ID> (2,211)
359439836

>  <transfer_container_id> (2,211)
PTN000000075

>  <COMPOUND_NUMBER> (2,211)
WAY-352156

>  <BAR_CODE_NO> (2,211)
2562441

>  <LOCATION_CODE> (2,211)
PTNCS

>  <AMOUNT_CURRENT> (2,211)
32.5

$$$$
WAY-352200
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
    9.0250   -5.3917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9292   -6.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3542  -12.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0625  -12.1917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5917   -5.4792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1500   -8.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0542   -9.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 16  1  0  0  0  0
  5  7  1  0  0  0  0
  6  2  1  0  0  0  0
  7 13  1  0  0  0  0
  8  1  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 11  3  2  0  0  0  0
 12  6  1  0  0  0  0
 13 20  2  0  0  0  0
 14  5  1  0  0  0  0
 15  5  1  0  0  0  0
 16 17  1  0  0  0  0
 17  1  1  0  0  0  0
 18 12  1  0  0  0  0
 19 12  2  0  0  0  0
 20 19  1  0  0  0  0
 21 18  2  0  0  0  0
  4  3  1  0  0  0  0
 21 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,212)
2212

>  <Formula> (2,212)
C13H15F2N3O2S

>  <MolWeight> (2,212)
315.3389064

>  <PCAT_CMPD_ID> (2,212)
WAY-352200

>  <CNC_ID> (2,212)
359439880

>  <transfer_container_id> (2,212)
PTN000000075

>  <COMPOUND_NUMBER> (2,212)
WAY-352200

>  <BAR_CODE_NO> (2,212)
2562480

>  <LOCATION_CODE> (2,212)
PTNCS

>  <AMOUNT_CURRENT> (2,212)
32.2

$$$$
WAY-352218
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
    5.4167   -2.7292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    6.1375   -2.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8000   -6.5917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4667   -8.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4667   -7.3417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8542   -2.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2792   -2.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5625   -3.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8 10  2  0  0  0  0
  9  3  2  0  0  0  0
 10 17  1  0  0  0  0
 11 15  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14 12  1  0  0  0  0
 15 16  2  0  0  0  0
 16  7  1  0  0  0  0
 17  9  1  0  0  0  0
 18 13  1  0  0  0  0
 19  2  2  0  0  0  0
 20 14  1  0  0  0  0
 21  4  2  0  0  0  0
 22 20  2  0  0  0  0
 23 11  1  0  0  0  0
 24 11  1  0  0  0  0
 25 11  1  0  0  0  0
 26 20  1  0  0  0  0
 27  7  2  0  0  0  0
 28  5  2  0  0  0  0
 29  6  2  0  0  0  0
 30 31  2  0  0  0  0
 31 27  1  0  0  0  0
 32 26  1  0  0  0  0
 33 29  1  0  0  0  0
 34 33  2  0  0  0  0
  5  3  1  0  0  0  0
 30 15  1  0  0  0  0
 34 28  1  0  0  0  0
 12 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,213)
2213

>  <Formula> (2,213)
C23H16F3N3O4S

>  <MolWeight> (2,213)
487.4510496

>  <PCAT_CMPD_ID> (2,213)
WAY-352218

>  <CNC_ID> (2,213)
359439898

>  <transfer_container_id> (2,213)
PTN000000075

>  <COMPOUND_NUMBER> (2,213)
WAY-352218

>  <BAR_CODE_NO> (2,213)
2562566

>  <LOCATION_CODE> (2,213)
PTNCS

>  <AMOUNT_CURRENT> (2,213)
32.8

$$$$
WAY-352424
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    7.2167   -5.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6000   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8125   -4.0167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   13.2667   -8.9542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6542   -6.5875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9042  -10.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2417  -11.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.3250   -7.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -11.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3167  -10.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2750  -12.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4667  -13.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  9  1  0  0  0  0
  9  7  2  0  0  0  0
 10 16  1  0  0  0  0
 11 10  1  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17 14  2  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20 17  1  0  0  0  0
 21 22  1  0  0  0  0
 22 13  2  0  0  0  0
 23 21  2  0  0  0  0
 24 20  1  0  0  0  0
  5  4  2  0  0  0  0
  6  8  2  0  0  0  0
 17 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,214)
2214

>  <Formula> (2,214)
C17H17N3O3S

>  <MolWeight> (2,214)
343.40018

>  <PCAT_CMPD_ID> (2,214)
WAY-352424

>  <CNC_ID> (2,214)
359440101

>  <transfer_container_id> (2,214)
PTN000000075

>  <COMPOUND_NUMBER> (2,214)
WAY-352424

>  <BAR_CODE_NO> (2,214)
2562746

>  <LOCATION_CODE> (2,214)
PTNCS

>  <AMOUNT_CURRENT> (2,214)
32.9

$$$$
WAY-352446
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.1828   -1.8242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1828   -2.7898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6552   -1.3415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4897   -4.7173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3241   -4.2346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0172    5.4102    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
  7 10  1  0  0  0  0
 12 14  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,215)
2215

>  <Formula> (2,215)
C19H21ClN2O

>  <MolWeight> (2,215)
328.83584

>  <PCAT_CMPD_ID> (2,215)
WAY-352446

>  <CNC_ID> (2,215)
359440122

>  <transfer_container_id> (2,215)
PTN000000075

>  <COMPOUND_NUMBER> (2,215)
WAY-352446

>  <BAR_CODE_NO> (2,215)
2562768

>  <LOCATION_CODE> (2,215)
PTNCS

>  <AMOUNT_CURRENT> (2,215)
32.3

$$$$
WAY-352515
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    6.2417   -0.6167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.0167   -1.3750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8292   -5.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3500   -4.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  3  2  0  0  0  0
  9  5  1  0  0  0  0
 10 13  1  0  0  0  0
 11  4  2  0  0  0  0
 12  4  1  0  0  0  0
 13  8  1  0  0  0  0
 14  2  1  0  0  0  0
 15  5  2  0  0  0  0
 16 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18  2  1  0  0  0  0
 19  3  1  0  0  0  0
 20 19  2  0  0  0  0
 21 22  1  0  0  0  0
 22 12  2  0  0  0  0
 23 11  1  0  0  0  0
 24 20  1  0  0  0  0
 25 14  2  0  0  0  0
 26 14  1  0  0  0  0
 27 25  1  0  0  0  0
 28 26  2  0  0  0  0
 29 28  1  0  0  0  0
 24 13  2  0  0  0  0
 27 29  2  0  0  0  0
 23 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,216)
2216

>  <Formula> (2,216)
C21H18ClFN2O3S

>  <MolWeight> (2,216)
432.8956232

>  <PCAT_CMPD_ID> (2,216)
WAY-352515

>  <CNC_ID> (2,216)
359440189

>  <transfer_container_id> (2,216)
PTN000000075

>  <COMPOUND_NUMBER> (2,216)
WAY-352515

>  <BAR_CODE_NO> (2,216)
2562779

>  <LOCATION_CODE> (2,216)
PTNCS

>  <AMOUNT_CURRENT> (2,216)
26.7

$$$$
WAY-352554
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    8.1125   -5.6125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.1167   -9.3167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  1  2  0  0  0  0
 11  2  2  0  0  0  0
 12  2  2  0  0  0  0
 13  3  2  0  0  0  0
 14  8  2  0  0  0  0
 15  6  1  0  0  0  0
 16  6  1  0  0  0  0
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 18  4  1  0  0  0  0
 19 17  2  0  0  0  0
 20 15  1  0  0  0  0
 21 13  1  0  0  0  0
 22  5  1  0  0  0  0
 23  5  1  0  0  0  0
 24 18  2  0  0  0  0
 25 24  1  0  0  0  0
 26 21  1  0  0  0  0
 27 23  1  0  0  0  0
 28 22  1  0  0  0  0
 29 27  1  0  0  0  0
 28 29  1  0  0  0  0
 19 14  1  0  0  0  0
 25 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,217)
2217

>  <Formula> (2,217)
C18H20Cl2N2O5S2

>  <MolWeight> (2,217)
479.3978

>  <PCAT_CMPD_ID> (2,217)
WAY-352554

>  <CNC_ID> (2,217)
359440227

>  <transfer_container_id> (2,217)
PTN000000075

>  <COMPOUND_NUMBER> (2,217)
WAY-352554

>  <BAR_CODE_NO> (2,217)
2562867

>  <LOCATION_CODE> (2,217)
PTNCS

>  <AMOUNT_CURRENT> (2,217)
32.9

$$$$
WAY-352563
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    3.4702    3.7631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0753    3.7934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1884    4.9614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4005    5.0238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5417    2.5119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6170    1.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4294    1.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5779    8.6055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  4  2  0  0  0  0
 10  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 17  2  0  0  0  0
 14 12  1  0  0  0  0
 15 12  2  0  0  0  0
 16 14  2  0  0  0  0
 17 15  1  0  0  0  0
 18  5  2  0  0  0  0
 19  6  2  0  0  0  0
 20 13  1  0  0  0  0
 21 22  2  0  0  0  0
 22 19  1  0  0  0  0
  5  4  1  0  0  0  0
 18 21  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,218)
2218

>  <Formula> (2,218)
C18H14O4

>  <MolWeight> (2,218)
294.30136

>  <PCAT_CMPD_ID> (2,218)
WAY-352563

>  <CNC_ID> (2,218)
359440235

>  <transfer_container_id> (2,218)
PTN000000075

>  <COMPOUND_NUMBER> (2,218)
WAY-352563

>  <BAR_CODE_NO> (2,218)
2562876

>  <LOCATION_CODE> (2,218)
PTNCS

>  <AMOUNT_CURRENT> (2,218)
32.3

$$$$
WAY-352582
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    3.6500   -2.4417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4542   -2.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4667   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  9  1  0  0  0  0
  8  2  1  0  0  0  0
  9 13  1  0  0  0  0
 10  6  2  0  0  0  0
 11  6  1  0  0  0  0
 12  9  2  0  0  0  0
 13  8  1  0  0  0  0
 14 10  1  0  0  0  0
 15  1  1  0  0  0  0
 16 11  2  0  0  0  0
 17 16  1  0  0  0  0
 18  5  1  0  0  0  0
 19 10  1  0  0  0  0
 20 16  1  0  0  0  0
 21 15  1  0  0  0  0
 22 18  1  0  0  0  0
 23 21  1  0  0  0  0
  4  3  1  0  0  0  0
 23 22  1  0  0  0  0
 17 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,219)
2219

>  <Formula> (2,219)
C17H22N4OS

>  <MolWeight> (2,219)
330.44778

>  <PCAT_CMPD_ID> (2,219)
WAY-352582

>  <CNC_ID> (2,219)
359440253

>  <transfer_container_id> (2,219)
PTN000000075

>  <COMPOUND_NUMBER> (2,219)
WAY-352582

>  <BAR_CODE_NO> (2,219)
2562880

>  <LOCATION_CODE> (2,219)
PTNCS

>  <AMOUNT_CURRENT> (2,219)
33

$$$$
WAY-352632
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    8.0042   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6500   -5.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.1542    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  2  0  0  0  0
  7  2  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  1  0  0  0  0
 10  6  1  0  0  0  0
 11 20  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 21  1  0  0  0  0
 15 14  1  0  0  0  0
 16  9  2  0  0  0  0
 17 13  1  0  0  0  0
 18 16  1  0  0  0  0
 19 14  2  0  0  0  0
 20 15  1  0  0  0  0
 21 12  1  0  0  0  0
 22 11  1  0  0  0  0
 23 11  1  0  0  0  0
 24 11  1  0  0  0  0
 25 10  1  0  0  0  0
  8  7  1  0  0  0  0
  5 10  2  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,220)
2220

>  <Formula> (2,220)
C15H12F3N3OS3

>  <MolWeight> (2,220)
403.4654896

>  <PCAT_CMPD_ID> (2,220)
WAY-352632

>  <CNC_ID> (2,220)
359440300

>  <transfer_container_id> (2,220)
PTN000000075

>  <COMPOUND_NUMBER> (2,220)
WAY-352632

>  <BAR_CODE_NO> (2,220)
2562932

>  <LOCATION_CODE> (2,220)
PTNCS

>  <AMOUNT_CURRENT> (2,220)
32.6

$$$$
WAY-352700
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   -0.6036    0.4760    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7036   -0.4654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3657    1.0035    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  3  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
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 10 15  1  0  0  0  0
 10 16  2  0  0  0  0
 11 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 19  2  0  0  0  0
 15 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  2  0  0  0  0
 20 23  1  0  0  0  0
 20 24  2  0  0  0  0
 21 25  1  0  0  0  0
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 23 27  1  0  0  0  0
 24 28  1  0  0  0  0
 26 29  1  0  0  0  0
 12 17  2  0  0  0  0
 19 22  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,221)
2221

>  <Formula> (2,221)
C21H19ClN2O4S

>  <MolWeight> (2,221)
430.90456

>  <PCAT_CMPD_ID> (2,221)
WAY-352700

>  <CNC_ID> (2,221)
359440366

>  <transfer_container_id> (2,221)
PTN000000075

>  <COMPOUND_NUMBER> (2,221)
WAY-352700

>  <BAR_CODE_NO> (2,221)
2563008

>  <LOCATION_CODE> (2,221)
PTNCS

>  <AMOUNT_CURRENT> (2,221)
26.1

$$$$
WAY-352714
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.1375   -4.5792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4500   -6.4667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9167   -5.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2667   -1.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  2  1  0  0  0  0
  4  9  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  2  0  0  0  0
  8  4  2  0  0  0  0
  9  1  1  0  0  0  0
 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  2  0  0  0  0
 18 12  1  0  0  0  0
 19 11  2  0  0  0  0
 20 14  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  2  0  0  0  0
 23 19  1  0  0  0  0
 24 16  2  0  0  0  0
 25 22  1  0  0  0  0
 26 23  2  0  0  0  0
 25 21  2  0  0  0  0
 24 26  1  0  0  0  0
  7 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,222)
2222

>  <Formula> (2,222)
C22H21FN2O

>  <MolWeight> (2,222)
348.4133432

>  <PCAT_CMPD_ID> (2,222)
WAY-352714

>  <CNC_ID> (2,222)
359440379

>  <transfer_container_id> (2,222)
PTN000000075

>  <COMPOUND_NUMBER> (2,222)
WAY-352714

>  <BAR_CODE_NO> (2,222)
2563046

>  <LOCATION_CODE> (2,222)
PTNCS

>  <AMOUNT_CURRENT> (2,222)
30

$$$$
WAY-352729
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    6.5500   -4.2042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8042   -4.2167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.9250   -2.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1417   -5.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1167   -7.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2625   -7.3875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9750   -6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7917   -7.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -4.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9000    0.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1542    0.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7 11  1  0  0  0  0
  8  3  2  0  0  0  0
  9  4  2  0  0  0  0
 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  2  1  0  0  0  0
 13 12  1  0  0  0  0
 14  3  1  0  0  0  0
 15 17  2  0  0  0  0
 16  5  1  0  0  0  0
 17  6  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  1  0  0  0  0
 20  8  1  0  0  0  0
 21 10  1  0  0  0  0
 22 14  2  0  0  0  0
 23 22  1  0  0  0  0
 18  8  1  0  0  0  0
 20 23  2  0  0  0  0
 19 10  2  0  0  0  0
M  END
>  <Mol_ID> (2,223)
2223

>  <Formula> (2,223)
C20H23NO2

>  <MolWeight> (2,223)
309.40212

>  <PCAT_CMPD_ID> (2,223)
WAY-352729

>  <CNC_ID> (2,223)
359440394

>  <transfer_container_id> (2,223)
PTN000000075

>  <COMPOUND_NUMBER> (2,223)
WAY-352729

>  <BAR_CODE_NO> (2,223)
2563052

>  <LOCATION_CODE> (2,223)
PTNCS

>  <AMOUNT_CURRENT> (2,223)
32.5

$$$$
WAY-352739
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
    1.2188    7.4212    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.9945    1.2794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8899    6.2067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3169    2.5069    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4420    8.1010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.7523    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3844    1.2535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.5146    2.4225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4 13  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9  7  1  0  0  0  0
 10  2  2  0  0  0  0
 11  3  1  0  0  0  0
 12  3  2  0  0  0  0
 13 14  1  0  0  0  0
 14 16  2  0  0  0  0
 15 11  2  0  0  0  0
 16 12  1  0  0  0  0
 17  9  2  0  0  0  0
 18  7  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 15 14  1  0  0  0  0
 19 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,224)
2224

>  <Formula> (2,224)
C13H13N3O3S

>  <MolWeight> (2,224)
291.32562

>  <PCAT_CMPD_ID> (2,224)
WAY-352739

>  <CNC_ID> (2,224)
359440404

>  <transfer_container_id> (2,224)
PTN000000075

>  <COMPOUND_NUMBER> (2,224)
WAY-352739

>  <BAR_CODE_NO> (2,224)
2563063

>  <LOCATION_CODE> (2,224)
PTNCS

>  <AMOUNT_CURRENT> (2,224)
32.7

$$$$
WAY-352898
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   12.2125   -2.6792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.5417   -4.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9875   -0.9042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.9792   -6.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5292   -8.4292    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7 19  2  0  0  0  0
  8 10  2  0  0  0  0
  9  5  1  0  0  0  0
 10 13  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13  6  1  0  0  0  0
 14  2  2  0  0  0  0
 15  3  2  0  0  0  0
 16  5  2  0  0  0  0
 17  9  1  0  0  0  0
 18 16  1  0  0  0  0
 19 24  1  0  0  0  0
 20  1  1  0  0  0  0
 21  8  1  0  0  0  0
 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
 24 13  2  0  0  0  0
 25  4  1  0  0  0  0
 26 20  1  0  0  0  0
 26 25  1  0  0  0  0
 17 18  2  0  0  0  0
  8  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,225)
2225

>  <Formula> (2,225)
C17H15ClF2N2O3S

>  <MolWeight> (2,225)
400.8274064

>  <PCAT_CMPD_ID> (2,225)
WAY-352898

>  <CNC_ID> (2,225)
359440558

>  <transfer_container_id> (2,225)
PTN000000075

>  <COMPOUND_NUMBER> (2,225)
WAY-352898

>  <BAR_CODE_NO> (2,225)
2563234

>  <LOCATION_CODE> (2,225)
PTNCS

>  <AMOUNT_CURRENT> (2,225)
32.7

$$$$
WAY-352900
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.4292   -7.3167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.8167   -6.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.6125   -7.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.1917   -6.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.4042   -8.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2542   -5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  4  1  0  0  0  0
  7  9  1  0  0  0  0
  8  2  1  0  0  0  0
  9  8  2  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  7  1  0  0  0  0
 13  3  1  0  0  0  0
 14  5  2  0  0  0  0
 15  7  2  0  0  0  0
 16  9  1  0  0  0  0
 17 12  1  0  0  0  0
 18  6  2  0  0  0  0
 19  4  2  0  0  0  0
 20 17  1  0  0  0  0
 21 17  1  0  0  0  0
 22 17  1  0  0  0  0
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
 25 20  1  0  0  0  0
  3  5  1  0  0  0  0
 18 23  1  0  0  0  0
 13 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,226)
2226

>  <Formula> (2,226)
C19H19NO4S

>  <MolWeight> (2,226)
357.42346

>  <PCAT_CMPD_ID> (2,226)
WAY-352900

>  <CNC_ID> (2,226)
359440560

>  <transfer_container_id> (2,226)
PTN000000075

>  <COMPOUND_NUMBER> (2,226)
WAY-352900

>  <BAR_CODE_NO> (2,226)
2563236

>  <LOCATION_CODE> (2,226)
PTNCS

>  <AMOUNT_CURRENT> (2,226)
32.1

$$$$
WAY-352919
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    8.2625   -5.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -5.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6667   -1.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2667   -3.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5792   -8.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1875   -6.4875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0542   -7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1000   -8.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5667  -10.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5917   -7.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  2  0  0  0  0
  7  2  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  1  0  0  0  0
 10  6  1  0  0  0  0
 11  4  1  0  0  0  0
 12  9  1  0  0  0  0
 13 20  1  0  0  0  0
 14 13  1  0  0  0  0
 15  9  2  0  0  0  0
 16 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 14  1  0  0  0  0
 19 13  2  0  0  0  0
 20 11  1  0  0  0  0
 21 10  1  0  0  0  0
 22 18  1  0  0  0  0
 23 18  1  0  0  0  0
 24 18  1  0  0  0  0
  7  8  1  0  0  0  0
 10  5  2  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,227)
2227

>  <Formula> (2,227)
C17H19N3OS3

>  <MolWeight> (2,227)
377.54726

>  <PCAT_CMPD_ID> (2,227)
WAY-352919

>  <CNC_ID> (2,227)
359440580

>  <transfer_container_id> (2,227)
PTN000000075

>  <COMPOUND_NUMBER> (2,227)
WAY-352919

>  <BAR_CODE_NO> (2,227)
2563240

>  <LOCATION_CODE> (2,227)
PTNCS

>  <AMOUNT_CURRENT> (2,227)
32.8

$$$$
WAY-353352
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
    8.3167   -3.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5500   -2.5250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5917   -3.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792   -4.5792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.4417   -5.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1667   -5.6917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.2417   -4.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3292   -2.9417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3750   -4.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0667   -4.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1000   -6.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6042   -5.7292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5167   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4792   -7.9000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.4250   -3.4625    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3417   -4.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3750   -6.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3417   -4.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6 13  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  2  0  0  0  0
 11  5  1  0  0  0  0
 12  7  2  0  0  0  0
 13  7  1  0  0  0  0
 14 11  1  0  0  0  0
 15 10  1  0  0  0  0
 16 18  1  0  0  0  0
 17  9  1  0  0  0  0
 18 11  2  0  0  0  0
 19 10  1  0  0  0  0
  9  8  2  0  0  0  0
 16 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,228)
2228

>  <Formula> (2,228)
C12H10Cl2N2OS2

>  <MolWeight> (2,228)
333.2566

>  <PCAT_CMPD_ID> (2,228)
WAY-353352

>  <CNC_ID> (2,228)
359440998

>  <transfer_container_id> (2,228)
PTN000000075

>  <COMPOUND_NUMBER> (2,228)
WAY-353352

>  <BAR_CODE_NO> (2,228)
2563710

>  <LOCATION_CODE> (2,228)
PTNCS

>  <AMOUNT_CURRENT> (2,228)
32.4

$$$$
WAY-353370
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    9.0750   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1375   -7.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9250   -9.2125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8292   -8.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2917   -5.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9500    0.1958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0917   -1.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0625    2.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8542   -3.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3792   -1.7292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9917  -11.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9250    4.1250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5417   -3.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9667   -3.7375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9542   -1.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8875   -8.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3792    2.2125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9625   -8.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3250    0.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3625    4.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0667  -12.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0167  -12.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4958    2.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0875  -14.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1375  -14.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1250  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7 10  1  0  0  0  0
  8  6  2  0  0  0  0
  9  1  1  0  0  0  0
 10 13  1  0  0  0  0
 11  3  1  0  0  0  0
 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
 14  7  2  0  0  0  0
 15  9  2  0  0  0  0
 16  2  1  0  0  0  0
 17  8  1  0  0  0  0
 18  4  1  0  0  0  0
 19  6  1  0  0  0  0
 20 23  1  0  0  0  0
 21 11  2  0  0  0  0
 22 11  1  0  0  0  0
 23 19  2  0  0  0  0
 24 22  2  0  0  0  0
 25 21  1  0  0  0  0
 26 24  1  0  0  0  0
  3  4  1  0  0  0  0
 26 25  2  0  0  0  0
 20 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,229)
2229

>  <Formula> (2,229)
C20H18N2O4

>  <MolWeight> (2,229)
350.36792

>  <PCAT_CMPD_ID> (2,229)
WAY-353370

>  <CNC_ID> (2,229)
359441014

>  <transfer_container_id> (2,229)
PTN000000075

>  <COMPOUND_NUMBER> (2,229)
WAY-353370

>  <BAR_CODE_NO> (2,229)
2563775

>  <LOCATION_CODE> (2,229)
PTNCS

>  <AMOUNT_CURRENT> (2,229)
32.6

$$$$
WAY-353412
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
    8.1167   -4.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9250   -4.8875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6292   -7.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4417  -12.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3542   -3.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1917   -8.0917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9125  -11.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8875   -5.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -12.1625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7417   -3.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2292   -6.0875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9792   -2.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6917   -5.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4542   -7.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7167  -11.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5375  -10.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8417  -13.1125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7500   -9.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -2.8417    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.9417   -9.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1375  -10.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1625   -3.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5125   -4.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4042   -1.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5917   -2.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2167   -1.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 14  1  0  0  0  0
  4  7  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7 15  2  0  0  0  0
  8 13  1  0  0  0  0
  9  4  2  0  0  0  0
 10  1  2  0  0  0  0
 11  3  2  0  0  0  0
 12  5  1  0  0  0  0
 13  1  1  0  0  0  0
 14  8  1  0  0  0  0
 15 21  1  0  0  0  0
 16 20  2  0  0  0  0
 17  4  1  0  0  0  0
 18  6  1  0  0  0  0
 19 12  1  0  0  0  0
 20 18  1  0  0  0  0
 21 18  2  0  0  0  0
 22  5  2  0  0  0  0
 23  8  1  0  0  0  0
 24 12  2  0  0  0  0
 25 22  1  0  0  0  0
 26 25  2  0  0  0  0
 24 26  1  0  0  0  0
 16  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,230)
2230

>  <Formula> (2,230)
C18H19ClN4O3

>  <MolWeight> (2,230)
374.82146

>  <PCAT_CMPD_ID> (2,230)
WAY-353412

>  <CNC_ID> (2,230)
359441051

>  <transfer_container_id> (2,230)
PTN000000075

>  <COMPOUND_NUMBER> (2,230)
WAY-353412

>  <BAR_CODE_NO> (2,230)
2563750

>  <LOCATION_CODE> (2,230)
PTNCS

>  <AMOUNT_CURRENT> (2,230)
32.2

$$$$
WAY-353414
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    9.5792   -4.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2042   -5.3875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.5542   -6.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2417   -6.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2792   -4.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6042   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2375   -3.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4292   -8.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5667   -7.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0667   -9.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0667   -7.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1875   -7.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6125   -1.9917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1292   -8.7375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5417   -3.1417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4250   -6.4875    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   13.4292  -10.9542    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   11.4792   -7.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6375   -3.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3042   -5.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3542   -9.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3500   -7.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6667   -4.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3417   -3.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  6  1  0  0  0  0
  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  1  1  0  0  0  0
  8 14  1  0  0  0  0
  9  4  2  0  0  0  0
 10  8  2  0  0  0  0
 11  8  1  0  0  0  0
 12  3  1  0  0  0  0
 13  7  2  0  0  0  0
 14 18  1  0  0  0  0
 15  7  1  0  0  0  0
 16 11  1  0  0  0  0
 17 10  1  0  0  0  0
 18 12  1  0  0  0  0
 19  5  1  0  0  0  0
 20  6  1  0  0  0  0
 21 23  1  0  0  0  0
 22 10  1  0  0  0  0
 23 11  2  0  0  0  0
 24 25  1  0  0  0  0
 25 19  2  0  0  0  0
  3  4  1  0  0  0  0
 20 24  2  0  0  0  0
 22 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,231)
2231

>  <Formula> (2,231)
C17H12Cl2N2O4

>  <MolWeight> (2,231)
379.19418

>  <PCAT_CMPD_ID> (2,231)
WAY-353414

>  <CNC_ID> (2,231)
359441053

>  <transfer_container_id> (2,231)
PTN000000075

>  <COMPOUND_NUMBER> (2,231)
WAY-353414

>  <BAR_CODE_NO> (2,231)
2563752

>  <LOCATION_CODE> (2,231)
PTNCS

>  <AMOUNT_CURRENT> (2,231)
32.3

$$$$
WAY-353002
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    9.7542   -5.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9292   -4.5750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1292   -5.6500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0542   -6.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6375   -5.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8375   -6.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6167   -8.1417    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.9625   -6.7875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.6667   -6.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1500   -5.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1292   -8.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3917   -6.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5167   -4.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2375   -7.9042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7167   -5.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3792   -3.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3167   -3.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  5  1  0  0  0  0
 14  6  2  0  0  0  0
 15 13  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  1  0  0  0  0
 18 11  1  0  0  0  0
  5  9  2  0  0  0  0
 11 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,232)
2232

>  <Formula> (2,232)
C13H16N2OS2

>  <MolWeight> (2,232)
280.40894

>  <PCAT_CMPD_ID> (2,232)
WAY-353002

>  <CNC_ID> (2,232)
359440659

>  <transfer_container_id> (2,232)
PTN000000075

>  <COMPOUND_NUMBER> (2,232)
WAY-353002

>  <BAR_CODE_NO> (2,232)
2563316

>  <LOCATION_CODE> (2,232)
PTNCS

>  <AMOUNT_CURRENT> (2,232)
12.4

$$$$
WAY-353084-A
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
   12.9542   -9.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3417   -8.3375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1667   -9.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7250   -7.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0792   -5.2667    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.3875  -10.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6625   -4.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3000   -6.2667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -5.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0042  -11.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7917  -10.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9000   -6.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1917  -11.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.3750    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   10.5125   -7.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6917   -6.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1500  -10.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2500   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2792   -6.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0417   -4.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0667   -6.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4542   -5.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5 16  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  6  2  0  0  0  0
 11  3  1  0  0  0  0
 12 15  1  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  4  1  0  0  0  0
 16 12  1  0  0  0  0
 17  7  1  0  0  0  0
 18  7  1  0  0  0  0
 19  6  1  0  0  0  0
 20  9  2  0  0  0  0
 21  9  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  2  0  0  0  0
 24 23  1  0  0  0  0
 11 13  2  0  0  0  0
 22 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,233)
2233

>  <Formula> (2,233)
C19H24ClN3O

>  <MolWeight> (2,233)
345.86636

>  <PCAT_CMPD_ID> (2,233)
WAY-353084-A

>  <CNC_ID> (2,233)
359440739

>  <transfer_container_id> (2,233)
PTN000000075

>  <COMPOUND_NUMBER> (2,233)
WAY-353084-A

>  <BAR_CODE_NO> (2,233)
2563476

>  <LOCATION_CODE> (2,233)
PTNCS

>  <AMOUNT_CURRENT> (2,233)
32.2

$$$$
WAY-353120
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    3.8292   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6042   -8.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4417   -8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3792   -9.9375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6042   -7.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9917   -9.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8375   -8.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2167   -7.0875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2125  -10.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3792  -11.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6792   -4.2750    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   11.7667  -11.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -8.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7917   -9.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3792   -7.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 14  1  0  0  0  0
  3  8  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  2  0  0  0  0
  7  4  1  0  0  0  0
  8  7  2  0  0  0  0
  9  5  1  0  0  0  0
 10 12  1  0  0  0  0
 11  2  2  0  0  0  0
 12 15  2  0  0  0  0
 13  1  1  0  0  0  0
 14  9  1  0  0  0  0
 15  7  1  0  0  0  0
 16  6  1  0  0  0  0
 17  3  1  0  0  0  0
 18 17  1  0  0  0  0
 19 22  2  0  0  0  0
 20  5  2  0  0  0  0
 21 10  1  0  0  0  0
 22  6  1  0  0  0  0
 19 20  1  0  0  0  0
  3 10  2  0  0  0  0
 21 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,234)
2234

>  <Formula> (2,234)
C17H15Cl2NO2

>  <MolWeight> (2,234)
336.2125

>  <PCAT_CMPD_ID> (2,234)
WAY-353120

>  <CNC_ID> (2,234)
359440775

>  <transfer_container_id> (2,234)
PTN000000075

>  <COMPOUND_NUMBER> (2,234)
WAY-353120

>  <BAR_CODE_NO> (2,234)
2563508

>  <LOCATION_CODE> (2,234)
PTNCS

>  <AMOUNT_CURRENT> (2,234)
32.6

$$$$
WAY-353135
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    5.1875   -7.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3792  -11.2875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1667   -9.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9667   -5.0917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.7875   -7.0917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.8000  -11.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.0000   -9.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9833   -2.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9875  -13.3750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8750    1.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 10  2  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6 11  1  0  0  0  0
  7  2  1  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  1  0  0  0  0
 11 17  2  0  0  0  0
 12  1  2  0  0  0  0
 13  8  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
 16  7  2  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
 19  4  1  0  0  0  0
 20  8  2  0  0  0  0
 21 13  2  0  0  0  0
 22 18  1  0  0  0  0
 23 20  1  0  0  0  0
 24 23  2  0  0  0  0
 11  3  1  0  0  0  0
 15  7  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,235)
2235

>  <Formula> (2,235)
C18H18N2O3S

>  <MolWeight> (2,235)
342.41212

>  <PCAT_CMPD_ID> (2,235)
WAY-353135

>  <CNC_ID> (2,235)
359440789

>  <transfer_container_id> (2,235)
PTN000000075

>  <COMPOUND_NUMBER> (2,235)
WAY-353135

>  <BAR_CODE_NO> (2,235)
2563493

>  <LOCATION_CODE> (2,235)
PTNCS

>  <AMOUNT_CURRENT> (2,235)
33

$$$$
WAY-353251
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   11.4125   -7.8917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9625   -5.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6417   -6.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.2500   -9.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -7.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3  6  1  0  0  0  0
  4  1  2  0  0  0  0
  5  3  1  0  0  0  0
  6 10  2  0  0  0  0
  7  4  1  0  0  0  0
  8  1  1  0  0  0  0
  9  8  2  0  0  0  0
 10  4  1  0  0  0  0
 11 15  2  0  0  0  0
 12 11  1  0  0  0  0
 13  5  1  0  0  0  0
 14  3  2  0  0  0  0
 15 13  1  0  0  0  0
 16  6  1  0  0  0  0
 17  7  1  0  0  0  0
 18 12  2  0  0  0  0
 19 22  2  0  0  0  0
 20  8  1  0  0  0  0
 21  9  1  0  0  0  0
 22 23  1  0  0  0  0
 23 13  2  0  0  0  0
 24 12  1  0  0  0  0
 25 20  1  0  0  0  0
 26 21  1  0  0  0  0
  2  7  2  0  0  0  0
 17 16  2  0  0  0  0
 19 11  1  0  0  0  0
M  END
>  <Mol_ID> (2,236)
2236

>  <Formula> (2,236)
C21H21N3O2

>  <MolWeight> (2,236)
347.41034

>  <PCAT_CMPD_ID> (2,236)
WAY-353251

>  <CNC_ID> (2,236)
359440899

>  <transfer_container_id> (2,236)
PTN000000075

>  <COMPOUND_NUMBER> (2,236)
WAY-353251

>  <BAR_CODE_NO> (2,236)
2563625

>  <LOCATION_CODE> (2,236)
PTNCS

>  <AMOUNT_CURRENT> (2,236)
32.2

$$$$
WAY-353261
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
   12.6167  -11.8292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2542  -11.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3000  -13.2917    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.4167  -10.6125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8042  -10.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3125   -7.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9917  -13.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2292  -11.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1375   -9.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0167   -6.5875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.7750   -8.0167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8917   -3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0667   -2.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000  -14.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4125   -0.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  9  1  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10  6  1  0  0  0  0
 11  2  2  0  0  0  0
 12  6  2  0  0  0  0
 13 10  1  0  0  0  0
 14 18  1  0  0  0  0
 15 13  2  0  0  0  0
 16 13  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  2  0  0  0  0
 19  4  1  0  0  0  0
 20 14  1  0  0  0  0
 21  7  1  0  0  0  0
 22 20  1  0  0  0  0
  8  7  2  0  0  0  0
 17 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,237)
2237

>  <Formula> (2,237)
C16H18N2O3S

>  <MolWeight> (2,237)
318.39072

>  <PCAT_CMPD_ID> (2,237)
WAY-353261

>  <CNC_ID> (2,237)
359440909

>  <transfer_container_id> (2,237)
PTN000000075

>  <COMPOUND_NUMBER> (2,237)
WAY-353261

>  <BAR_CODE_NO> (2,237)
2563617

>  <LOCATION_CODE> (2,237)
PTNCS

>  <AMOUNT_CURRENT> (2,237)
32.8

$$$$
WAY-353265
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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    7.9542   -5.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  4  1  0  0  0  0
  7 14  1  0  0  0  0
  8  7  1  0  0  0  0
  9  2  2  0  0  0  0
 10  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
 13  6  2  0  0  0  0
 14  5  1  0  0  0  0
 15 16  1  0  0  0  0
 16  6  1  0  0  0  0
 17 15  1  0  0  0  0
 18 24  1  0  0  0  0
 19 18  1  0  0  0  0
 20  1  2  0  0  0  0
 21 17  2  0  0  0  0
 22 17  1  0  0  0  0
 23 21  1  0  0  0  0
 24 22  2  0  0  0  0
 25  3  2  0  0  0  0
 26 20  1  0  0  0  0
 27 26  2  0  0  0  0
 25 27  1  0  0  0  0
 11 12  2  0  0  0  0
 23 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,238)
2238

>  <Formula> (2,238)
C20H17ClN2O4

>  <MolWeight> (2,238)
384.81298

>  <PCAT_CMPD_ID> (2,238)
WAY-353265

>  <CNC_ID> (2,238)
359440913

>  <transfer_container_id> (2,238)
PTN000000075

>  <COMPOUND_NUMBER> (2,238)
WAY-353265

>  <BAR_CODE_NO> (2,238)
2563694

>  <LOCATION_CODE> (2,238)
PTNCS

>  <AMOUNT_CURRENT> (2,238)
33

$$$$
WAY-353464
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.3500  -10.6792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.9750  -11.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7292   -9.6292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3667  -12.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2875  -11.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0375   -9.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.2250  -16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  9  1  0  0  0  0
  6  4  2  0  0  0  0
  7  1  2  0  0  0  0
  8  1  2  0  0  0  0
  9 15  2  0  0  0  0
 10 12  2  0  0  0  0
 11  2  2  0  0  0  0
 12 11  1  0  0  0  0
 13 23  1  0  0  0  0
 14  3  1  0  0  0  0
 15 19  1  0  0  0  0
 16 18  2  0  0  0  0
 17  6  1  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20 10  1  0  0  0  0
 21  5  1  0  0  0  0
 22  5  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
 25 20  1  0  0  0  0
 16  9  1  0  0  0  0
  6 10  1  0  0  0  0
 24 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,239)
2239

>  <Formula> (2,239)
C17H19BrN2O4S

>  <MolWeight> (2,239)
427.31276

>  <PCAT_CMPD_ID> (2,239)
WAY-353464

>  <CNC_ID> (2,239)
359441099

>  <transfer_container_id> (2,239)
PTN000000075

>  <COMPOUND_NUMBER> (2,239)
WAY-353464

>  <BAR_CODE_NO> (2,239)
2563832

>  <LOCATION_CODE> (2,239)
PTNCS

>  <AMOUNT_CURRENT> (2,239)
32.3

$$$$
WAY-353504
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.4451   -0.3912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4451    0.6364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  3  9  2  0  0  0  0
  4 10  2  0  0  0  0
  5 11  2  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
  5  7  1  0  0  0  0
 10 12  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,240)
2240

>  <Formula> (2,240)
C14H10FNO3S

>  <MolWeight> (2,240)
291.2975032

>  <PCAT_CMPD_ID> (2,240)
WAY-353504

>  <CNC_ID> (2,240)
359441137

>  <transfer_container_id> (2,240)
PTN000000075

>  <COMPOUND_NUMBER> (2,240)
WAY-353504

>  <BAR_CODE_NO> (2,240)
2563894

>  <LOCATION_CODE> (2,240)
PTNCS

>  <AMOUNT_CURRENT> (2,240)
32.1

$$$$
WAY-353526
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5 10  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  2  0  0  0  0
  8  3  2  0  0  0  0
  9  4  1  0  0  0  0
 10 16  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
 13 14  1  0  0  0  0
 14 21  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
 19 13  1  0  0  0  0
 20 11  1  0  0  0  0
 21 12  1  0  0  0  0
 22  3  1  0  0  0  0
 23 19  1  0  0  0  0
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 27 26  2  0  0  0  0
 20 14  1  0  0  0  0
 10 15  2  0  0  0  0
 27 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,241)
2241

>  <Formula> (2,241)
C22H27N3O2

>  <MolWeight> (2,241)
365.46868

>  <PCAT_CMPD_ID> (2,241)
WAY-353526

>  <CNC_ID> (2,241)
359441156

>  <transfer_container_id> (2,241)
PTN000000075

>  <COMPOUND_NUMBER> (2,241)
WAY-353526

>  <BAR_CODE_NO> (2,241)
2563887

>  <LOCATION_CODE> (2,241)
PTNCS

>  <AMOUNT_CURRENT> (2,241)
32

$$$$
WAY-353756
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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   12.5500   -7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6250   -4.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8000   -9.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4042   -3.0292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1750   -6.4875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6375   -1.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3667   -2.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2417   -9.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9292   -5.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2542   -7.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9292   -7.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0917  -10.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -8.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8792  -11.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.7292  -12.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0542  -12.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  4  1  0  0  0  0
 14  5  2  0  0  0  0
 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 11  1  0  0  0  0
 19 13  2  0  0  0  0
 20  4  2  0  0  0  0
 21 20  1  0  0  0  0
 22 11  2  0  0  0  0
 23 18  1  0  0  0  0
 24 18  2  0  0  0  0
 25 21  2  0  0  0  0
 26 19  1  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
 25 19  1  0  0  0  0
 16 17  2  0  0  0  0
 28 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,242)
2242

>  <Formula> (2,242)
C21H22N2O4S

>  <MolWeight> (2,242)
398.47538

>  <PCAT_CMPD_ID> (2,242)
WAY-353756

>  <CNC_ID> (2,242)
359441385

>  <transfer_container_id> (2,242)
PTN000000075

>  <COMPOUND_NUMBER> (2,242)
WAY-353756

>  <BAR_CODE_NO> (2,242)
2564192

>  <LOCATION_CODE> (2,242)
PTNCS

>  <AMOUNT_CURRENT> (2,242)
32.9

$$$$
WAY-353770
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
   13.3292   -3.9667    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.5125   -4.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1750   -4.6292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.5375   -4.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3417   -4.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9542   -3.5792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3167   -4.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3167   -2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8875   -3.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2542   -2.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3417   -3.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2542   -3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7792   -5.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.8375   -5.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1667   -4.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0042   -5.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7167   -3.6667    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.6417   -1.8417    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   14.8417   -6.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2875   -0.8667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2167   -0.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1667   -6.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  2  0  0  0  0
  8  9  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13 17  1  0  0  0  0
 14  2  2  0  0  0  0
 15  5  1  0  0  0  0
 16 10  2  0  0  0  0
 17 15  2  0  0  0  0
 18 25  1  0  0  0  0
 19  3  1  0  0  0  0
 20  3  1  0  0  0  0
 21 10  1  0  0  0  0
 22 16  1  0  0  0  0
 23  8  2  0  0  0  0
 24  6  1  0  0  0  0
 25 20  1  0  0  0  0
 26 19  1  0  0  0  0
 27 23  1  0  0  0  0
 28 27  2  0  0  0  0
 29 13  1  0  0  0  0
 18 26  1  0  0  0  0
 13  4  2  0  0  0  0
 16 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,243)
2243

>  <Formula> (2,243)
C20H22Cl2N2O4S

>  <MolWeight> (2,243)
457.37068

>  <PCAT_CMPD_ID> (2,243)
WAY-353770

>  <CNC_ID> (2,243)
359441399

>  <transfer_container_id> (2,243)
PTN000000075

>  <COMPOUND_NUMBER> (2,243)
WAY-353770

>  <BAR_CODE_NO> (2,243)
2564122

>  <LOCATION_CODE> (2,243)
PTNCS

>  <AMOUNT_CURRENT> (2,243)
32.8

$$$$
WAY-353807
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   12.2792   -8.1375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.4375   -9.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0500   -8.1417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2125   -9.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5000   -8.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6167  -10.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0542  -10.2875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5875   -8.1875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1292   -9.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2917   -9.3625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2625   -6.9125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2417  -11.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4542  -11.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3250   -6.0792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1042   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3625   -8.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3292   -7.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3542   -9.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5542   -6.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7167   -7.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4667   -5.9917    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   15.9542   -8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -10.2250    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.6917   -5.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6500   -2.8792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6417  -12.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0917  -12.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2875   -3.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4917  -13.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2667  -13.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7  2  2  0  0  0  0
  8  4  1  0  0  0  0
  9  5  2  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 13  1  0  0  0  0
 13  7  1  0  0  0  0
 14 21  1  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 17  8  1  0  0  0  0
 18 15  2  0  0  0  0
 19  9  1  0  0  0  0
 20 16  1  0  0  0  0
 21 17  1  0  0  0  0
 22 15  1  0  0  0  0
 23 18  1  0  0  0  0
 24 19  1  0  0  0  0
 25 14  1  0  0  0  0
 26 29  1  0  0  0  0
 27 12  2  0  0  0  0
 28 13  2  0  0  0  0
 29 25  1  0  0  0  0
 30 28  1  0  0  0  0
 31 30  2  0  0  0  0
 19 23  2  0  0  0  0
 12  6  1  0  0  0  0
 14 20  1  0  0  0  0
 27 31  1  0  0  0  0
M  END
>  <Mol_ID> (2,244)
2244

>  <Formula> (2,244)
C20H21F2N5O3S

>  <MolWeight> (2,244)
449.4742464

>  <PCAT_CMPD_ID> (2,244)
WAY-353807

>  <CNC_ID> (2,244)
359441436

>  <transfer_container_id> (2,244)
PTN000000075

>  <COMPOUND_NUMBER> (2,244)
WAY-353807

>  <BAR_CODE_NO> (2,244)
2564326

>  <LOCATION_CODE> (2,244)
PTNCS

>  <AMOUNT_CURRENT> (2,244)
32.3

$$$$
WAY-353843
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
   13.1917   -7.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0250   -7.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7250   -9.1167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.3542   -6.7292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.2417   -6.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3625   -5.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1750   -9.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4292   -7.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0292   -6.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0292   -5.5917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4417   -8.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3542   -4.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0292   -4.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3625   -3.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0042   -5.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0250   -3.2875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3542   -2.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0167   -3.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0250   -2.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3542   -4.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3292   -4.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  9  1  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10  6  1  0  0  0  0
 11  2  2  0  0  0  0
 12 10  1  0  0  0  0
 13  6  2  0  0  0  0
 14 12  2  0  0  0  0
 15 14  1  0  0  0  0
 16  4  1  0  0  0  0
 17 15  1  0  0  0  0
 18 20  2  0  0  0  0
 19  7  1  0  0  0  0
 20 12  1  0  0  0  0
 21 18  1  0  0  0  0
 22 17  1  0  0  0  0
 23 16  1  0  0  0  0
  7  8  2  0  0  0  0
 21 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,245)
2245

>  <Formula> (2,245)
C17H20N2O3S

>  <MolWeight> (2,245)
332.4173

>  <PCAT_CMPD_ID> (2,245)
WAY-353843

>  <CNC_ID> (2,245)
359441472

>  <transfer_container_id> (2,245)
PTN000000075

>  <COMPOUND_NUMBER> (2,245)
WAY-353843

>  <BAR_CODE_NO> (2,245)
2564417

>  <LOCATION_CODE> (2,245)
PTNCS

>  <AMOUNT_CURRENT> (2,245)
32.1

$$$$
WAY-353847
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.4792  -10.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6375  -12.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9042   -9.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6375  -10.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9042  -11.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.2167  -12.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4792  -12.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7000   -8.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7542   -9.9875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2042  -13.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1792   -8.9917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.4875   -8.9917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9625  -10.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 15  9  2  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,246)
2246

>  <Formula> (2,246)
C20H23N3O2

>  <MolWeight> (2,246)
337.41552

>  <PCAT_CMPD_ID> (2,246)
WAY-353847

>  <CNC_ID> (2,246)
359441476

>  <transfer_container_id> (2,246)
PTN000000075

>  <COMPOUND_NUMBER> (2,246)
WAY-353847

>  <BAR_CODE_NO> (2,246)
2564204

>  <LOCATION_CODE> (2,246)
PTNCS

>  <AMOUNT_CURRENT> (2,246)
21.56

$$$$
WAY-353857
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,247)
2247

>  <Formula> (2,247)
C15H18N4O2

>  <MolWeight> (2,247)
286.32902

>  <PCAT_CMPD_ID> (2,247)
WAY-353857

>  <CNC_ID> (2,247)
359441486

>  <transfer_container_id> (2,247)
PTN000000075

>  <COMPOUND_NUMBER> (2,247)
WAY-353857

>  <BAR_CODE_NO> (2,247)
2564221

>  <LOCATION_CODE> (2,247)
PTNCS

>  <AMOUNT_CURRENT> (2,247)
32.7

$$$$
WAY-354030
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 17 20  1  0  0  0  0
  5  7  1  0  0  0  0
  9 12  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,248)
2248

>  <Formula> (2,248)
C14H10FNO3S

>  <MolWeight> (2,248)
291.2975032

>  <PCAT_CMPD_ID> (2,248)
WAY-354030

>  <CNC_ID> (2,248)
359441658

>  <transfer_container_id> (2,248)
PTN000000075

>  <COMPOUND_NUMBER> (2,248)
WAY-354030

>  <BAR_CODE_NO> (2,248)
2564419

>  <LOCATION_CODE> (2,248)
PTNCS

>  <AMOUNT_CURRENT> (2,248)
32.7

$$$$
WAY-354053
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 21 22  2  0  0  0  0
 11  3  2  0  0  0  0
M  END
>  <Mol_ID> (2,249)
2249

>  <Formula> (2,249)
C18H19FN2O

>  <MolWeight> (2,249)
298.3546632

>  <PCAT_CMPD_ID> (2,249)
WAY-354053

>  <CNC_ID> (2,249)
359441681

>  <transfer_container_id> (2,249)
PTN000000075

>  <COMPOUND_NUMBER> (2,249)
WAY-354053

>  <BAR_CODE_NO> (2,249)
2564442

>  <LOCATION_CODE> (2,249)
PTNCS

>  <AMOUNT_CURRENT> (2,249)
32.5

$$$$
WAY-354453
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,250)
2250

>  <Formula> (2,250)
C13H13BrN2O2

>  <MolWeight> (2,250)
309.15852

>  <PCAT_CMPD_ID> (2,250)
WAY-354453

>  <CNC_ID> (2,250)
359442024

>  <transfer_container_id> (2,250)
PTN000000075

>  <COMPOUND_NUMBER> (2,250)
WAY-354453

>  <BAR_CODE_NO> (2,250)
2564643

>  <LOCATION_CODE> (2,250)
PTNCS

>  <AMOUNT_CURRENT> (2,250)
32.3

$$$$
WAY-354507
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 26 25  1  0  0  0  0
 27 24  2  0  0  0  0
 28 23  1  0  0  0  0
 29 27  1  0  0  0  0
  5  3  1  0  0  0  0
  8 13  2  0  0  0  0
 28 29  2  0  0  0  0
 22 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,251)
2251

>  <Formula> (2,251)
C21H15BrFN3O2S

>  <MolWeight> (2,251)
472.3301032

>  <PCAT_CMPD_ID> (2,251)
WAY-354507

>  <CNC_ID> (2,251)
359442077

>  <transfer_container_id> (2,251)
PTN000000075

>  <COMPOUND_NUMBER> (2,251)
WAY-354507

>  <BAR_CODE_NO> (2,251)
2564673

>  <LOCATION_CODE> (2,251)
PTNCS

>  <AMOUNT_CURRENT> (2,251)
32.5

$$$$
WAY-354611
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   14.1667   -8.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5 14  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  1  2  0  0  0  0
 10  2  2  0  0  0  0
 11  5  2  0  0  0  0
 12 15  2  0  0  0  0
 13  4  2  0  0  0  0
 14 16  1  0  0  0  0
 15 11  1  0  0  0  0
 16  3  1  0  0  0  0
 17  9  1  0  0  0  0
 18  7  2  0  0  0  0
 19 17  2  0  0  0  0
 20 10  1  0  0  0  0
 21  9  1  0  0  0  0
 22 15  1  0  0  0  0
 23 17  1  0  0  0  0
 24 22  1  0  0  0  0
 25 24  1  0  0  0  0
 19 13  1  0  0  0  0
  3  8  2  0  0  0  0
 12 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,252)
2252

>  <Formula> (2,252)
C19H20N2O3S

>  <MolWeight> (2,252)
356.4387

>  <PCAT_CMPD_ID> (2,252)
WAY-354611

>  <CNC_ID> (2,252)
359442178

>  <transfer_container_id> (2,252)
PTN000000075

>  <COMPOUND_NUMBER> (2,252)
WAY-354611

>  <BAR_CODE_NO> (2,252)
2564818

>  <LOCATION_CODE> (2,252)
PTNCS

>  <AMOUNT_CURRENT> (2,252)
32.5

$$$$
WAY-354715
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   14.1167   -8.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.8917   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  8  5  2  0  0  0  0
  9  7  1  0  0  0  0
 10 16  1  0  0  0  0
 11  3  1  0  0  0  0
 12 10  1  0  0  0  0
 13 14  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16 11  1  0  0  0  0
 17 10  2  0  0  0  0
 18 13  2  0  0  0  0
 19 15  1  0  0  0  0
 20 18  1  0  0  0  0
 21  5  1  0  0  0  0
 22  8  1  0  0  0  0
 23 12  1  0  0  0  0
 24  9  1  0  0  0  0
  8  4  1  0  0  0  0
  6  9  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,253)
2253

>  <Formula> (2,253)
C17H19N3O2S2

>  <MolWeight> (2,253)
361.48166

>  <PCAT_CMPD_ID> (2,253)
WAY-354715

>  <CNC_ID> (2,253)
359442280

>  <transfer_container_id> (2,253)
PTN000000075

>  <COMPOUND_NUMBER> (2,253)
WAY-354715

>  <BAR_CODE_NO> (2,253)
2564970

>  <LOCATION_CODE> (2,253)
PTNCS

>  <AMOUNT_CURRENT> (2,253)
32.8

$$$$
WAY-354799
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
  3  8  2  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  2  2  0  0  0  0
  8  2  1  0  0  0  0
  9  1  1  0  0  0  0
 10  4  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13 14  1  0  0  0  0
 14 16  1  0  0  0  0
 15 19  1  0  0  0  0
 16 10  1  0  0  0  0
 17  6  2  0  0  0  0
 18 13  2  0  0  0  0
 19 13  1  0  0  0  0
 20  4  1  0  0  0  0
 21  7  1  0  0  0  0
 22  8  1  0  0  0  0
 23 20  2  0  0  0  0
 24  9  1  0  0  0  0
 25  9  1  0  0  0  0
 26 23  1  0  0  0  0
 16 26  2  0  0  0  0
  3  5  1  0  0  0  0
M  END
>  <Mol_ID> (2,254)
2254

>  <Formula> (2,254)
C16H19N3O6S

>  <MolWeight> (2,254)
381.40356

>  <PCAT_CMPD_ID> (2,254)
WAY-354799

>  <CNC_ID> (2,254)
359442361

>  <transfer_container_id> (2,254)
PTN000000075

>  <COMPOUND_NUMBER> (2,254)
WAY-354799

>  <BAR_CODE_NO> (2,254)
2565067

>  <LOCATION_CODE> (2,254)
PTNCS

>  <AMOUNT_CURRENT> (2,254)
33

$$$$
CL-422841
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 21 24  1  0  0  0  0
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 29 30  1  0  0  0  0
  5  7  2  0  0  0  0
  9 11  2  0  0  0  0
 19 20  1  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,255)
2255

>  <Formula> (2,255)
C23H20FN5O

>  <MolWeight> (2,255)
401.4362032

>  <PCAT_CMPD_ID> (2,255)
CL-422841

>  <CNC_ID> (2,255)
359442430

>  <transfer_container_id> (2,255)
PTN000000076

>  <COMPOUND_NUMBER> (2,255)
CL-422841

>  <BAR_CODE_NO> (2,255)
2569241

>  <LOCATION_CODE> (2,255)
PTNCS

>  <AMOUNT_CURRENT> (2,255)
32.4

$$$$
GI-505946
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    1.3889   -0.3184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (2,256)
2256

>  <Formula> (2,256)
C12H9Cl2N3O

>  <MolWeight> (2,256)
282.12536

>  <PCAT_CMPD_ID> (2,256)
GI-505946

>  <CNC_ID> (2,256)
359442434

>  <transfer_container_id> (2,256)
PTN000000076

>  <COMPOUND_NUMBER> (2,256)
GI-505946

>  <BAR_CODE_NO> (2,256)
2571133

>  <LOCATION_CODE> (2,256)
PTNCS

>  <AMOUNT_CURRENT> (2,256)
32.1

$$$$
GI-570663
csChFnd80/10111816222D

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 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 22 23  1  0  0  0  0
  5  7  1  0  0  0  0
  9 13  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,257)
2257

>  <Formula> (2,257)
C16H24N4O2S

>  <MolWeight> (2,257)
336.45236

>  <PCAT_CMPD_ID> (2,257)
GI-570663

>  <CNC_ID> (2,257)
359442449

>  <transfer_container_id> (2,257)
PTN000000076

>  <COMPOUND_NUMBER> (2,257)
GI-570663

>  <BAR_CODE_NO> (2,257)
2569045

>  <LOCATION_CODE> (2,257)
PTNCS

>  <AMOUNT_CURRENT> (2,257)
29

$$$$
WAY-134464
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  7  8  2  0  0  0  0
 10 12  1  0  0  0  0
 18 21  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,258)
2258

>  <Formula> (2,258)
C20H15N3O

>  <MolWeight> (2,258)
313.3526

>  <PCAT_CMPD_ID> (2,258)
WAY-134464

>  <CNC_ID> (2,258)
359442460

>  <transfer_container_id> (2,258)
PTN000000076

>  <COMPOUND_NUMBER> (2,258)
WAY-134464

>  <BAR_CODE_NO> (2,258)
2571222

>  <LOCATION_CODE> (2,258)
PTNCS

>  <AMOUNT_CURRENT> (2,258)
32.4

$$$$
WAY-344311
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,259)
2259

>  <Formula> (2,259)
C12H12N2OS2

>  <MolWeight> (2,259)
264.36648

>  <PCAT_CMPD_ID> (2,259)
WAY-344311

>  <CNC_ID> (2,259)
359442499

>  <transfer_container_id> (2,259)
PTN000000076

>  <COMPOUND_NUMBER> (2,259)
WAY-344311

>  <BAR_CODE_NO> (2,259)
2571182

>  <LOCATION_CODE> (2,259)
PTNCS

>  <AMOUNT_CURRENT> (2,259)
32.7

$$$$
WAY-345196
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,260)
2260

>  <Formula> (2,260)
C17H25NO3

>  <MolWeight> (2,260)
291.3853

>  <PCAT_CMPD_ID> (2,260)
WAY-345196

>  <CNC_ID> (2,260)
359442503

>  <transfer_container_id> (2,260)
PTN000000076

>  <COMPOUND_NUMBER> (2,260)
WAY-345196

>  <BAR_CODE_NO> (2,260)
2570694

>  <LOCATION_CODE> (2,260)
PTNCS

>  <AMOUNT_CURRENT> (2,260)
32.3

$$$$
WAY-346671
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,261)
2261

>  <Formula> (2,261)
C15H15N3O3

>  <MolWeight> (2,261)
285.2979

>  <PCAT_CMPD_ID> (2,261)
WAY-346671

>  <CNC_ID> (2,261)
359442519

>  <transfer_container_id> (2,261)
PTN000000076

>  <COMPOUND_NUMBER> (2,261)
WAY-346671

>  <BAR_CODE_NO> (2,261)
2569787

>  <LOCATION_CODE> (2,261)
PTNCS

>  <AMOUNT_CURRENT> (2,261)
32.7

$$$$
WAY-346705
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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   -3.2000    0.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.9458    0.9625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6 13  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  2  0  0  0  0
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 10  1  1  0  0  0  0
 11  6  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  3  2  0  0  0  0
 15  2  2  0  0  0  0
 16  7  2  0  0  0  0
 17  4  1  0  0  0  0
 18  5  1  0  0  0  0
 19 17  2  0  0  0  0
 20 18  2  0  0  0  0
  5  4  2  0  0  0  0
 20 19  1  0  0  0  0
  9  8  1  0  0  0  0
M  END
>  <Mol_ID> (2,262)
2262

>  <Formula> (2,262)
C12H9N5O3

>  <MolWeight> (2,262)
271.23156

>  <PCAT_CMPD_ID> (2,262)
WAY-346705

>  <CNC_ID> (2,262)
359442520

>  <transfer_container_id> (2,262)
PTN000000076

>  <COMPOUND_NUMBER> (2,262)
WAY-346705

>  <BAR_CODE_NO> (2,262)
2569769

>  <LOCATION_CODE> (2,262)
PTNCS

>  <AMOUNT_CURRENT> (2,262)
32.7

$$$$
WAY-350355
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7  8  1  0  0  0  0
  8 14  1  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  5  2  0  0  0  0
 12  9  2  0  0  0  0
 13  8  2  0  0  0  0
 14 10  1  0  0  0  0
 15 12  1  0  0  0  0
 16  2  1  0  0  0  0
 17  6  1  0  0  0  0
 18  9  1  0  0  0  0
 19 12  1  0  0  0  0
 20 18  2  0  0  0  0
 21 20  1  0  0  0  0
  3  6  1  0  0  0  0
 19 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,263)
2263

>  <Formula> (2,263)
C15H14FNO4

>  <MolWeight> (2,263)
291.2743632

>  <PCAT_CMPD_ID> (2,263)
WAY-350355

>  <CNC_ID> (2,263)
359442568

>  <transfer_container_id> (2,263)
PTN000000076

>  <COMPOUND_NUMBER> (2,263)
WAY-350355

>  <BAR_CODE_NO> (2,263)
2572860

>  <LOCATION_CODE> (2,263)
PTNCS

>  <AMOUNT_CURRENT> (2,263)
32.3

$$$$
WAY-354875
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
    6.7667   -7.3417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  2  1  0  0  0  0
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  8  2  2  0  0  0  0
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 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  1  0  0  0  0
 13  9  2  0  0  0  0
 14 13  1  0  0  0  0
 15 12  1  0  0  0  0
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 18 15  1  0  0  0  0
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 21 16  1  0  0  0  0
 22 24  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  2  0  0  0  0
 25 22  1  0  0  0  0
  7  8  1  0  0  0  0
  6  5  1  0  0  0  0
 18 19  2  0  0  0  0
 14 11  2  0  0  0  0
 23 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,264)
2264

>  <Formula> (2,264)
C17H9FN4O2S

>  <MolWeight> (2,264)
352.3423632

>  <PCAT_CMPD_ID> (2,264)
WAY-354875

>  <CNC_ID> (2,264)
359442649

>  <transfer_container_id> (2,264)
PTN000000076

>  <COMPOUND_NUMBER> (2,264)
WAY-354875

>  <BAR_CODE_NO> (2,264)
2565130

>  <LOCATION_CODE> (2,264)
PTNCS

>  <AMOUNT_CURRENT> (2,264)
32.9

$$$$
WAY-355166
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   13.3125   -8.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10 13  2  0  0  0  0
 11  3  1  0  0  0  0
 12 14  2  0  0  0  0
 13 19  1  0  0  0  0
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 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18  5  1  0  0  0  0
 19 17  1  0  0  0  0
 20 15  1  0  0  0  0
 21 16  1  0  0  0  0
  5  6  2  0  0  0  0
  7  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,265)
2265

>  <Formula> (2,265)
C16H19NO3S

>  <MolWeight> (2,265)
305.39196

>  <PCAT_CMPD_ID> (2,265)
WAY-355166

>  <CNC_ID> (2,265)
359442933

>  <transfer_container_id> (2,265)
PTN000000076

>  <COMPOUND_NUMBER> (2,265)
WAY-355166

>  <BAR_CODE_NO> (2,265)
2565413

>  <LOCATION_CODE> (2,265)
PTNCS

>  <AMOUNT_CURRENT> (2,265)
33

$$$$
WAY-355299
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 11  6  2  0  0  0  0
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  4  5  1  0  0  0  0
 15 13  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,266)
2266

>  <Formula> (2,266)
C17H16N2OS

>  <MolWeight> (2,266)
296.38674

>  <PCAT_CMPD_ID> (2,266)
WAY-355299

>  <CNC_ID> (2,266)
359443062

>  <transfer_container_id> (2,266)
PTN000000076

>  <COMPOUND_NUMBER> (2,266)
WAY-355299

>  <BAR_CODE_NO> (2,266)
2565631

>  <LOCATION_CODE> (2,266)
PTNCS

>  <AMOUNT_CURRENT> (2,266)
32.3

$$$$
WAY-356541
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 21 20  1  0  0  0  0
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M  END
>  <Mol_ID> (2,267)
2267

>  <Formula> (2,267)
C19H15NO4

>  <MolWeight> (2,267)
321.3267

>  <PCAT_CMPD_ID> (2,267)
WAY-356541

>  <CNC_ID> (2,267)
359444280

>  <transfer_container_id> (2,267)
PTN000000076

>  <COMPOUND_NUMBER> (2,267)
WAY-356541

>  <BAR_CODE_NO> (2,267)
2567667

>  <LOCATION_CODE> (2,267)
PTNCS

>  <AMOUNT_CURRENT> (2,267)
32.2

$$$$
WAY-356776
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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M  END
>  <Mol_ID> (2,268)
2268

>  <Formula> (2,268)
C19H20Cl2N2O5S

>  <MolWeight> (2,268)
459.3435

>  <PCAT_CMPD_ID> (2,268)
WAY-356776

>  <CNC_ID> (2,268)
359444513

>  <transfer_container_id> (2,268)
PTN000000076

>  <COMPOUND_NUMBER> (2,268)
WAY-356776

>  <BAR_CODE_NO> (2,268)
2567823

>  <LOCATION_CODE> (2,268)
PTNCS

>  <AMOUNT_CURRENT> (2,268)
32

$$$$
WAY-357998
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 26 29  1  0  0  0  0
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M  END
>  <Mol_ID> (2,269)
2269

>  <Formula> (2,269)
C22H18N2O4S2

>  <MolWeight> (2,269)
438.51932

>  <PCAT_CMPD_ID> (2,269)
WAY-357998

>  <CNC_ID> (2,269)
359445738

>  <transfer_container_id> (2,269)
PTN000000076

>  <COMPOUND_NUMBER> (2,269)
WAY-357998

>  <BAR_CODE_NO> (2,269)
2569144

>  <LOCATION_CODE> (2,269)
PTNCS

>  <AMOUNT_CURRENT> (2,269)
32.9

$$$$
WAY-358033
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,270)
2270

>  <Formula> (2,270)
C20H14ClN3O2

>  <MolWeight> (2,270)
363.79706

>  <PCAT_CMPD_ID> (2,270)
WAY-358033

>  <CNC_ID> (2,270)
359445773

>  <transfer_container_id> (2,270)
PTN000000076

>  <COMPOUND_NUMBER> (2,270)
WAY-358033

>  <BAR_CODE_NO> (2,270)
2569196

>  <LOCATION_CODE> (2,270)
PTNCS

>  <AMOUNT_CURRENT> (2,270)
32.3

$$$$
WAY-358412
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
 12  2  1  0  0  0  0
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 15  8  2  0  0  0  0
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 20  6  1  0  0  0  0
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  7  8  1  0  0  0  0
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 26 21  1  0  0  0  0
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M  END
>  <Mol_ID> (2,271)
2271

>  <Formula> (2,271)
C22H20ClN5OS

>  <MolWeight> (2,271)
437.9451

>  <PCAT_CMPD_ID> (2,271)
WAY-358412

>  <CNC_ID> (2,271)
359446136

>  <transfer_container_id> (2,271)
PTN000000076

>  <COMPOUND_NUMBER> (2,271)
WAY-358412

>  <BAR_CODE_NO> (2,271)
2569619

>  <LOCATION_CODE> (2,271)
PTNCS

>  <AMOUNT_CURRENT> (2,271)
32.7

$$$$
WAY-358425
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10 16  2  0  0  0  0
 11  5  1  0  0  0  0
 12  4  1  0  0  0  0
 13  3  2  0  0  0  0
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 15  6  2  0  0  0  0
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 18  4  2  0  0  0  0
 19  5  2  0  0  0  0
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M  END
>  <Mol_ID> (2,272)
2272

>  <Formula> (2,272)
C19H18N4O3S

>  <MolWeight> (2,272)
382.43622

>  <PCAT_CMPD_ID> (2,272)
WAY-358425

>  <CNC_ID> (2,272)
359446149

>  <transfer_container_id> (2,272)
PTN000000076

>  <COMPOUND_NUMBER> (2,272)
WAY-358425

>  <BAR_CODE_NO> (2,272)
2569686

>  <LOCATION_CODE> (2,272)
PTNCS

>  <AMOUNT_CURRENT> (2,272)
32.1

$$$$
WAY-358475
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
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 18 20  2  0  0  0  0
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 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,273)
2273

>  <Formula> (2,273)
C16H12N2O2

>  <MolWeight> (2,273)
264.27868

>  <PCAT_CMPD_ID> (2,273)
WAY-358475

>  <CNC_ID> (2,273)
359446195

>  <transfer_container_id> (2,273)
PTN000000076

>  <COMPOUND_NUMBER> (2,273)
WAY-358475

>  <BAR_CODE_NO> (2,273)
2569697

>  <LOCATION_CODE> (2,273)
PTNCS

>  <AMOUNT_CURRENT> (2,273)
32.3

$$$$
WAY-358476
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,274)
2274

>  <Formula> (2,274)
C17H14N2O3

>  <MolWeight> (2,274)
294.30466

>  <PCAT_CMPD_ID> (2,274)
WAY-358476

>  <CNC_ID> (2,274)
359446196

>  <transfer_container_id> (2,274)
PTN000000076

>  <COMPOUND_NUMBER> (2,274)
WAY-358476

>  <BAR_CODE_NO> (2,274)
2569698

>  <LOCATION_CODE> (2,274)
PTNCS

>  <AMOUNT_CURRENT> (2,274)
32.7

$$$$
WAY-358516
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
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 15  3  1  0  0  0  0
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 27 30  1  0  0  0  0
 19 17  1  0  0  0  0
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M  END
>  <Mol_ID> (2,275)
2275

>  <Formula> (2,275)
C24H18N4O2

>  <MolWeight> (2,275)
394.42532

>  <PCAT_CMPD_ID> (2,275)
WAY-358516

>  <CNC_ID> (2,275)
359446231

>  <transfer_container_id> (2,275)
PTN000000076

>  <COMPOUND_NUMBER> (2,275)
WAY-358516

>  <BAR_CODE_NO> (2,275)
2569731

>  <LOCATION_CODE> (2,275)
PTNCS

>  <AMOUNT_CURRENT> (2,275)
32.4

$$$$
WAY-358576
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,276)
2276

>  <Formula> (2,276)
C19H14BrN5O3

>  <MolWeight> (2,276)
440.25016

>  <PCAT_CMPD_ID> (2,276)
WAY-358576

>  <CNC_ID> (2,276)
359446290

>  <transfer_container_id> (2,276)
PTN000000076

>  <COMPOUND_NUMBER> (2,276)
WAY-358576

>  <BAR_CODE_NO> (2,276)
2569761

>  <LOCATION_CODE> (2,276)
PTNCS

>  <AMOUNT_CURRENT> (2,276)
32.2

$$$$
WAY-358597
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
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 12  2  1  0  0  0  0
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 16  7  1  0  0  0  0
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M  END
>  <Mol_ID> (2,277)
2277

>  <Formula> (2,277)
C20H16BrN5O2

>  <MolWeight> (2,277)
438.27734

>  <PCAT_CMPD_ID> (2,277)
WAY-358597

>  <CNC_ID> (2,277)
359446310

>  <transfer_container_id> (2,277)
PTN000000076

>  <COMPOUND_NUMBER> (2,277)
WAY-358597

>  <BAR_CODE_NO> (2,277)
2569765

>  <LOCATION_CODE> (2,277)
PTNCS

>  <AMOUNT_CURRENT> (2,277)
32.9

$$$$
WAY-358660
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 16  6  1  0  0  0  0
 17  8  2  0  0  0  0
 18  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,278)
2278

>  <Formula> (2,278)
C19H17NO6

>  <MolWeight> (2,278)
355.34138

>  <PCAT_CMPD_ID> (2,278)
WAY-358660

>  <CNC_ID> (2,278)
359446372

>  <transfer_container_id> (2,278)
PTN000000076

>  <COMPOUND_NUMBER> (2,278)
WAY-358660

>  <BAR_CODE_NO> (2,278)
2569851

>  <LOCATION_CODE> (2,278)
PTNCS

>  <AMOUNT_CURRENT> (2,278)
32.6

$$$$
WAY-358666
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 11  4  1  0  0  0  0
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 13  6  1  0  0  0  0
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M  END
>  <Mol_ID> (2,279)
2279

>  <Formula> (2,279)
C22H23NO6

>  <MolWeight> (2,279)
397.42112

>  <PCAT_CMPD_ID> (2,279)
WAY-358666

>  <CNC_ID> (2,279)
359446378

>  <transfer_container_id> (2,279)
PTN000000076

>  <COMPOUND_NUMBER> (2,279)
WAY-358666

>  <BAR_CODE_NO> (2,279)
2569848

>  <LOCATION_CODE> (2,279)
PTNCS

>  <AMOUNT_CURRENT> (2,279)
32.3

$$$$
WAY-358744
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 19 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,280)
2280

>  <Formula> (2,280)
C11H9ClN4O3

>  <MolWeight> (2,280)
280.66716

>  <PCAT_CMPD_ID> (2,280)
WAY-358744

>  <CNC_ID> (2,280)
359446451

>  <transfer_container_id> (2,280)
PTN000000076

>  <COMPOUND_NUMBER> (2,280)
WAY-358744

>  <BAR_CODE_NO> (2,280)
2569937

>  <LOCATION_CODE> (2,280)
PTNCS

>  <AMOUNT_CURRENT> (2,280)
32.5

$$$$
WAY-358745
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  3  1  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
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 10  7  2  0  0  0  0
 11  8  2  0  0  0  0
 12  9  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 17  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19 14  1  0  0  0  0
  4  6  1  0  0  0  0
 16 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,281)
2281

>  <Formula> (2,281)
C11H9ClN4O3

>  <MolWeight> (2,281)
280.66716

>  <PCAT_CMPD_ID> (2,281)
WAY-358745

>  <CNC_ID> (2,281)
359446452

>  <transfer_container_id> (2,281)
PTN000000076

>  <COMPOUND_NUMBER> (2,281)
WAY-358745

>  <BAR_CODE_NO> (2,281)
2569932

>  <LOCATION_CODE> (2,281)
PTNCS

>  <AMOUNT_CURRENT> (2,281)
32.4

$$$$
WAY-358819
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
    2.0167    2.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  9  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  2  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  6  1  0  0  0  0
 12  8  1  0  0  0  0
 13  3  1  0  0  0  0
 14 11  1  0  0  0  0
 15 10  1  0  0  0  0
 16 12  1  0  0  0  0
 17 14  2  0  0  0  0
 18 15  2  0  0  0  0
 19 13  1  0  0  0  0
 20 16  1  0  0  0  0
 21  7  2  0  0  0  0
 22 20  2  0  0  0  0
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 24  4  1  0  0  0  0
 25  4  1  0  0  0  0
 26 17  1  0  0  0  0
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 28 20  1  0  0  0  0
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 30 29  1  0  0  0  0
 10 11  2  0  0  0  0
 18 17  1  0  0  0  0
 12 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,282)
2282

>  <Formula> (2,282)
C16H12Cl2F3N3O5S

>  <MolWeight> (2,282)
486.2497896

>  <PCAT_CMPD_ID> (2,282)
WAY-358819

>  <CNC_ID> (2,282)
359446521

>  <transfer_container_id> (2,282)
PTN000000076

>  <COMPOUND_NUMBER> (2,282)
WAY-358819

>  <BAR_CODE_NO> (2,282)
2570012

>  <LOCATION_CODE> (2,282)
PTNCS

>  <AMOUNT_CURRENT> (2,282)
32.9

$$$$
WAY-358830
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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 10  5  2  0  0  0  0
 11  9  1  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14 16  1  0  0  0  0
 15 12  1  0  0  0  0
 16 13  2  0  0  0  0
 17 14  1  0  0  0  0
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 19  9  1  0  0  0  0
 20 17  1  0  0  0  0
 21 19  1  0  0  0  0
  4  7  2  0  0  0  0
 21 18  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,283)
2283

>  <Formula> (2,283)
C15H16N2O3S

>  <MolWeight> (2,283)
304.36414

>  <PCAT_CMPD_ID> (2,283)
WAY-358830

>  <CNC_ID> (2,283)
359446532

>  <transfer_container_id> (2,283)
PTN000000076

>  <COMPOUND_NUMBER> (2,283)
WAY-358830

>  <BAR_CODE_NO> (2,283)
2570022

>  <LOCATION_CODE> (2,283)
PTNCS

>  <AMOUNT_CURRENT> (2,283)
32.2

$$$$
WAY-358847
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13 10  2  0  0  0  0
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 16 12  1  0  0  0  0
 17 12  2  0  0  0  0
 18 19  2  0  0  0  0
 19 17  1  0  0  0  0
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 21 18  1  0  0  0  0
  6  3  1  0  0  0  0
  5  8  1  0  0  0  0
 20 18  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,284)
2284

>  <Formula> (2,284)
C14H10ClN5S

>  <MolWeight> (2,284)
315.7807

>  <PCAT_CMPD_ID> (2,284)
WAY-358847

>  <CNC_ID> (2,284)
359446549

>  <transfer_container_id> (2,284)
PTN000000076

>  <COMPOUND_NUMBER> (2,284)
WAY-358847

>  <BAR_CODE_NO> (2,284)
2570042

>  <LOCATION_CODE> (2,284)
PTNCS

>  <AMOUNT_CURRENT> (2,284)
32.7

$$$$
WAY-358851
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
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 23 21  1  0  0  0  0
  3  5  1  0  0  0  0
 11 18  2  0  0  0  0
 22 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,285)
2285

>  <Formula> (2,285)
C16H10N2O3S2

>  <MolWeight> (2,285)
342.3922

>  <PCAT_CMPD_ID> (2,285)
WAY-358851

>  <CNC_ID> (2,285)
359446553

>  <transfer_container_id> (2,285)
PTN000000076

>  <COMPOUND_NUMBER> (2,285)
WAY-358851

>  <BAR_CODE_NO> (2,285)
2570056

>  <LOCATION_CODE> (2,285)
PTNCS

>  <AMOUNT_CURRENT> (2,285)
32.5

$$$$
WAY-358895
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,286)
2286

>  <Formula> (2,286)
C16H17NO

>  <MolWeight> (2,286)
239.31228

>  <PCAT_CMPD_ID> (2,286)
WAY-358895

>  <CNC_ID> (2,286)
359446596

>  <transfer_container_id> (2,286)
PTN000000076

>  <COMPOUND_NUMBER> (2,286)
WAY-358895

>  <BAR_CODE_NO> (2,286)
2570093

>  <LOCATION_CODE> (2,286)
PTNCS

>  <AMOUNT_CURRENT> (2,286)
32.4

$$$$
WAY-358910
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,287)
2287

>  <Formula> (2,287)
C12H12BrN3O

>  <MolWeight> (2,287)
294.14718

>  <PCAT_CMPD_ID> (2,287)
WAY-358910

>  <CNC_ID> (2,287)
359446616

>  <transfer_container_id> (2,287)
PTN000000076

>  <COMPOUND_NUMBER> (2,287)
WAY-358910

>  <BAR_CODE_NO> (2,287)
2570124

>  <LOCATION_CODE> (2,287)
PTNCS

>  <AMOUNT_CURRENT> (2,287)
32.6

$$$$
WAY-358928
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  6  9  1  0  0  0  0
 12 14  1  0  0  0  0
 17 18  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,288)
2288

>  <Formula> (2,288)
C15H12N6S

>  <MolWeight> (2,288)
308.36098

>  <PCAT_CMPD_ID> (2,288)
WAY-358928

>  <CNC_ID> (2,288)
359446634

>  <transfer_container_id> (2,288)
PTN000000076

>  <COMPOUND_NUMBER> (2,288)
WAY-358928

>  <BAR_CODE_NO> (2,288)
2570136

>  <LOCATION_CODE> (2,288)
PTNCS

>  <AMOUNT_CURRENT> (2,288)
32.4

$$$$
WAY-358939
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
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 15  3  1  0  0  0  0
 16  3  1  0  0  0  0
 17  3  1  0  0  0  0
 18  5  1  0  0  0  0
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 21  6  1  0  0  0  0
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 20  7  2  0  0  0  0
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 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,289)
2289

>  <Formula> (2,289)
C19H19F3N2O3S

>  <MolWeight> (2,289)
412.4259696

>  <PCAT_CMPD_ID> (2,289)
WAY-358939

>  <CNC_ID> (2,289)
359446645

>  <transfer_container_id> (2,289)
PTN000000076

>  <COMPOUND_NUMBER> (2,289)
WAY-358939

>  <BAR_CODE_NO> (2,289)
2570152

>  <LOCATION_CODE> (2,289)
PTNCS

>  <AMOUNT_CURRENT> (2,289)
32.7

$$$$
WAY-359274-A
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 16  4  1  0  0  0  0
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M  END
>  <Mol_ID> (2,290)
2290

>  <Formula> (2,290)
C22H26N2O3

>  <MolWeight> (2,290)
366.45344

>  <PCAT_CMPD_ID> (2,290)
WAY-359274-A

>  <CNC_ID> (2,290)
359446966

>  <transfer_container_id> (2,290)
PTN000000076

>  <COMPOUND_NUMBER> (2,290)
WAY-359274-A

>  <BAR_CODE_NO> (2,290)
2570516

>  <LOCATION_CODE> (2,290)
PTNCS

>  <AMOUNT_CURRENT> (2,290)
32.7

$$$$
WAY-358993
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,291)
2291

>  <Formula> (2,291)
C24H19N3O2

>  <MolWeight> (2,291)
381.42656

>  <PCAT_CMPD_ID> (2,291)
WAY-358993

>  <CNC_ID> (2,291)
359446698

>  <transfer_container_id> (2,291)
PTN000000076

>  <COMPOUND_NUMBER> (2,291)
WAY-358993

>  <BAR_CODE_NO> (2,291)
2570198

>  <LOCATION_CODE> (2,291)
PTNCS

>  <AMOUNT_CURRENT> (2,291)
32.5

$$$$
WAY-358994
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,292)
2292

>  <Formula> (2,292)
C23H18BrN5O

>  <MolWeight> (2,292)
460.32592

>  <PCAT_CMPD_ID> (2,292)
WAY-358994

>  <CNC_ID> (2,292)
359446699

>  <transfer_container_id> (2,292)
PTN000000076

>  <COMPOUND_NUMBER> (2,292)
WAY-358994

>  <BAR_CODE_NO> (2,292)
2570204

>  <LOCATION_CODE> (2,292)
PTNCS

>  <AMOUNT_CURRENT> (2,292)
32.5

$$$$
WAY-359033
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,293)
2293

>  <Formula> (2,293)
C20H17ClN2O2

>  <MolWeight> (2,293)
352.81418

>  <PCAT_CMPD_ID> (2,293)
WAY-359033

>  <CNC_ID> (2,293)
359446736

>  <transfer_container_id> (2,293)
PTN000000076

>  <COMPOUND_NUMBER> (2,293)
WAY-359033

>  <BAR_CODE_NO> (2,293)
2570251

>  <LOCATION_CODE> (2,293)
PTNCS

>  <AMOUNT_CURRENT> (2,293)
32.9

$$$$
WAY-359034
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,294)
2294

>  <Formula> (2,294)
C17H16N2O3S

>  <MolWeight> (2,294)
328.38554

>  <PCAT_CMPD_ID> (2,294)
WAY-359034

>  <CNC_ID> (2,294)
359446737

>  <transfer_container_id> (2,294)
PTN000000076

>  <COMPOUND_NUMBER> (2,294)
WAY-359034

>  <BAR_CODE_NO> (2,294)
2570252

>  <LOCATION_CODE> (2,294)
PTNCS

>  <AMOUNT_CURRENT> (2,294)
32.5

$$$$
WAY-359175
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,295)
2295

>  <Formula> (2,295)
C25H24N4O3S

>  <MolWeight> (2,295)
460.54806

>  <PCAT_CMPD_ID> (2,295)
WAY-359175

>  <CNC_ID> (2,295)
359446871

>  <transfer_container_id> (2,295)
PTN000000076

>  <COMPOUND_NUMBER> (2,295)
WAY-359175

>  <BAR_CODE_NO> (2,295)
2570407

>  <LOCATION_CODE> (2,295)
PTNCS

>  <AMOUNT_CURRENT> (2,295)
32.3

$$$$
WAY-359451
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11  5  1  0  0  0  0
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 17 15  1  0  0  0  0
 10  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,296)
2296

>  <Formula> (2,296)
C13H17N3O

>  <MolWeight> (2,296)
231.29358

>  <PCAT_CMPD_ID> (2,296)
WAY-359451

>  <CNC_ID> (2,296)
359447139

>  <transfer_container_id> (2,296)
PTN000000076

>  <COMPOUND_NUMBER> (2,296)
WAY-359451

>  <BAR_CODE_NO> (2,296)
2570702

>  <LOCATION_CODE> (2,296)
PTNCS

>  <AMOUNT_CURRENT> (2,296)
32.6

$$$$
WAY-359459
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  1  1  0  0  0  0
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 13  5  2  0  0  0  0
 14 10  1  0  0  0  0
 15  6  1  0  0  0  0
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  4  7  1  0  0  0  0
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 22 16  2  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,297)
2297

>  <Formula> (2,297)
C23H19N3O2

>  <MolWeight> (2,297)
369.41586

>  <PCAT_CMPD_ID> (2,297)
WAY-359459

>  <CNC_ID> (2,297)
359447147

>  <transfer_container_id> (2,297)
PTN000000076

>  <COMPOUND_NUMBER> (2,297)
WAY-359459

>  <BAR_CODE_NO> (2,297)
2570710

>  <LOCATION_CODE> (2,297)
PTNCS

>  <AMOUNT_CURRENT> (2,297)
32.9

$$$$
WAY-359464
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,298)
2298

>  <Formula> (2,298)
C24H21ClN4O3S

>  <MolWeight> (2,298)
480.96654

>  <PCAT_CMPD_ID> (2,298)
WAY-359464

>  <CNC_ID> (2,298)
359447152

>  <transfer_container_id> (2,298)
PTN000000076

>  <COMPOUND_NUMBER> (2,298)
WAY-359464

>  <BAR_CODE_NO> (2,298)
2570716

>  <LOCATION_CODE> (2,298)
PTNCS

>  <AMOUNT_CURRENT> (2,298)
32.1

$$$$
WAY-359505
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,299)
2299

>  <Formula> (2,299)
C12H11ClN2O3S2

>  <MolWeight> (2,299)
330.81034

>  <PCAT_CMPD_ID> (2,299)
WAY-359505

>  <CNC_ID> (2,299)
359447190

>  <transfer_container_id> (2,299)
PTN000000076

>  <COMPOUND_NUMBER> (2,299)
WAY-359505

>  <BAR_CODE_NO> (2,299)
2570771

>  <LOCATION_CODE> (2,299)
PTNCS

>  <AMOUNT_CURRENT> (2,299)
32.6

$$$$
WAY-359523
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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  6 12  1  0  0  0  0
  7  1  2  0  0  0  0
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  9  3  1  0  0  0  0
 10  4  2  0  0  0  0
 11 10  1  0  0  0  0
 12  2  1  0  0  0  0
 13  9  2  0  0  0  0
 14 13  1  0  0  0  0
 15  3  2  0  0  0  0
 16 15  1  0  0  0  0
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 18 12  1  0  0  0  0
 17 13  1  0  0  0  0
 11  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,300)
2300

>  <Formula> (2,300)
C14H14ClNOS

>  <MolWeight> (2,300)
279.78506

>  <PCAT_CMPD_ID> (2,300)
WAY-359523

>  <CNC_ID> (2,300)
359447208

>  <transfer_container_id> (2,300)
PTN000000076

>  <COMPOUND_NUMBER> (2,300)
WAY-359523

>  <BAR_CODE_NO> (2,300)
2570792

>  <LOCATION_CODE> (2,300)
PTNCS

>  <AMOUNT_CURRENT> (2,300)
32.5

$$$$
WAY-359617
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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 23 24  1  0  0  0  0
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 31 33  1  0  0  0  0
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  6  9  1  0  0  0  0
 14 17  1  0  0  0  0
 20 22  1  0  0  0  0
 27 28  1  0  0  0  0
 33 34  2  0  0  0  0
M  END
>  <Mol_ID> (2,301)
2301

>  <Formula> (2,301)
C26H21FN4O3

>  <MolWeight> (2,301)
456.4683432

>  <PCAT_CMPD_ID> (2,301)
WAY-359617

>  <CNC_ID> (2,301)
359447299

>  <transfer_container_id> (2,301)
PTN000000076

>  <COMPOUND_NUMBER> (2,301)
WAY-359617

>  <BAR_CODE_NO> (2,301)
2570892

>  <LOCATION_CODE> (2,301)
PTNCS

>  <AMOUNT_CURRENT> (2,301)
32

$$$$
WAY-359644-A
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  2  0  0  0  0
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 17 20  1  0  0  0  0
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 18 22  1  0  0  0  0
  7 10  1  0  0  0  0
  9 13  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,302)
2302

>  <Formula> (2,302)
C18H18N2O2

>  <MolWeight> (2,302)
294.34772

>  <PCAT_CMPD_ID> (2,302)
WAY-359644-A

>  <CNC_ID> (2,302)
359447326

>  <transfer_container_id> (2,302)
PTN000000076

>  <COMPOUND_NUMBER> (2,302)
WAY-359644-A

>  <BAR_CODE_NO> (2,302)
2570918

>  <LOCATION_CODE> (2,302)
PTNCS

>  <AMOUNT_CURRENT> (2,302)
29.6

$$$$
WAY-359748
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 12  5  1  0  0  0  0
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 16  4  2  0  0  0  0
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 19  2  1  0  0  0  0
 20  2  1  0  0  0  0
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 22 10  1  0  0  0  0
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 24  3  2  0  0  0  0
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 17 26  1  0  0  0  0
 25  9  1  0  0  0  0
 11  5  1  0  0  0  0
 13 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,303)
2303

>  <Formula> (2,303)
C19H20N2O6S

>  <MolWeight> (2,303)
404.4369

>  <PCAT_CMPD_ID> (2,303)
WAY-359748

>  <CNC_ID> (2,303)
359447430

>  <transfer_container_id> (2,303)
PTN000000076

>  <COMPOUND_NUMBER> (2,303)
WAY-359748

>  <BAR_CODE_NO> (2,303)
2571029

>  <LOCATION_CODE> (2,303)
PTNCS

>  <AMOUNT_CURRENT> (2,303)
32.7

$$$$
WAY-359838
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 18  6  2  0  0  0  0
 19  4  1  0  0  0  0
 20 12  1  0  0  0  0
 21 17  2  0  0  0  0
 22 18  1  0  0  0  0
 23  9  1  0  0  0  0
 18 21  1  0  0  0  0
 12 11  1  0  0  0  0
 20 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,304)
2304

>  <Formula> (2,304)
C18H22ClNO3

>  <MolWeight> (2,304)
335.82518

>  <PCAT_CMPD_ID> (2,304)
WAY-359838

>  <CNC_ID> (2,304)
359447519

>  <transfer_container_id> (2,304)
PTN000000076

>  <COMPOUND_NUMBER> (2,304)
WAY-359838

>  <BAR_CODE_NO> (2,304)
2571439

>  <LOCATION_CODE> (2,304)
PTNCS

>  <AMOUNT_CURRENT> (2,304)
32.7

$$$$
WAY-359931
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
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  4  1  1  0  0  0  0
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  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  2  0  0  0  0
  9  5  1  0  0  0  0
 10 13  1  0  0  0  0
 11  3  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 14  6  1  0  0  0  0
 15  7  1  0  0  0  0
 16 10  1  0  0  0  0
 17 15  2  0  0  0  0
 18 15  1  0  0  0  0
 19  4  1  0  0  0  0
 20  9  1  0  0  0  0
 21 16  1  0  0  0  0
 22 16  1  0  0  0  0
 23 21  1  0  0  0  0
 19 20  1  0  0  0  0
 10 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,305)
2305

>  <Formula> (2,305)
C17H21NO5

>  <MolWeight> (2,305)
319.35234

>  <PCAT_CMPD_ID> (2,305)
WAY-359931

>  <CNC_ID> (2,305)
359447611

>  <transfer_container_id> (2,305)
PTN000000076

>  <COMPOUND_NUMBER> (2,305)
WAY-359931

>  <BAR_CODE_NO> (2,305)
2571151

>  <LOCATION_CODE> (2,305)
PTNCS

>  <AMOUNT_CURRENT> (2,305)
32.4

$$$$
WAY-359956
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  5  1  0  0  0  0
 12  3  2  0  0  0  0
 13 18  2  0  0  0  0
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 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
 19  4  1  0  0  0  0
 20  8  1  0  0  0  0
 21  8  1  0  0  0  0
 22  8  1  0  0  0  0
 23 11  1  0  0  0  0
 19 23  1  0  0  0  0
  9 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,306)
2306

>  <Formula> (2,306)
C17H21NO5

>  <MolWeight> (2,306)
319.35234

>  <PCAT_CMPD_ID> (2,306)
WAY-359956

>  <CNC_ID> (2,306)
359447636

>  <transfer_container_id> (2,306)
PTN000000076

>  <COMPOUND_NUMBER> (2,306)
WAY-359956

>  <BAR_CODE_NO> (2,306)
2571226

>  <LOCATION_CODE> (2,306)
PTNCS

>  <AMOUNT_CURRENT> (2,306)
32.2

$$$$
WAY-380021
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10 18  1  0  0  0  0
 11 17  1  0  0  0  0
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 13  2  1  0  0  0  0
 14  2  2  0  0  0  0
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 20  1  2  0  0  0  0
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 24  8  2  0  0  0  0
 25 15  2  0  0  0  0
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 30 24  1  0  0  0  0
 21 28  1  0  0  0  0
 29 23  1  0  0  0  0
 18 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,307)
2307

>  <Formula> (2,307)
C23H15N3O3S

>  <MolWeight> (2,307)
413.4485

>  <PCAT_CMPD_ID> (2,307)
WAY-380021

>  <CNC_ID> (2,307)
359447702

>  <transfer_container_id> (2,307)
PTN000000076

>  <COMPOUND_NUMBER> (2,307)
WAY-380021

>  <BAR_CODE_NO> (2,307)
2571293

>  <LOCATION_CODE> (2,307)
PTNCS

>  <AMOUNT_CURRENT> (2,307)
32.2

$$$$
WAY-380051
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  2  2  0  0  0  0
 12  5  2  0  0  0  0
 13  4  1  0  0  0  0
 14 10  1  0  0  0  0
 15  7  2  0  0  0  0
 16  4  1  0  0  0  0
 17 15  1  0  0  0  0
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  8  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,308)
2308

>  <Formula> (2,308)
C12H11BrClNO3

>  <MolWeight> (2,308)
332.57764

>  <PCAT_CMPD_ID> (2,308)
WAY-380051

>  <CNC_ID> (2,308)
359447732

>  <transfer_container_id> (2,308)
PTN000000076

>  <COMPOUND_NUMBER> (2,308)
WAY-380051

>  <BAR_CODE_NO> (2,308)
2571326

>  <LOCATION_CODE> (2,308)
PTNCS

>  <AMOUNT_CURRENT> (2,308)
32.4

$$$$
WAY-380085
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,309)
2309

>  <Formula> (2,309)
C14H15NO5

>  <MolWeight> (2,309)
277.2726

>  <PCAT_CMPD_ID> (2,309)
WAY-380085

>  <CNC_ID> (2,309)
359447766

>  <transfer_container_id> (2,309)
PTN000000076

>  <COMPOUND_NUMBER> (2,309)
WAY-380085

>  <BAR_CODE_NO> (2,309)
2571369

>  <LOCATION_CODE> (2,309)
PTNCS

>  <AMOUNT_CURRENT> (2,309)
32.9

$$$$
WAY-380141
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    4.7625   -5.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6542   -8.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  5  2  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  2  2  0  0  0  0
 11 23  1  0  0  0  0
 12  3  1  0  0  0  0
 13 16  1  0  0  0  0
 14 12  2  0  0  0  0
 15 12  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18  4  1  0  0  0  0
 19  4  1  0  0  0  0
 20 22  1  0  0  0  0
 21  5  1  0  0  0  0
 22 21  2  0  0  0  0
 23 19  1  0  0  0  0
 24 18  1  0  0  0  0
 25 13  1  0  0  0  0
  6 20  2  0  0  0  0
 13 17  2  0  0  0  0
 24 11  1  0  0  0  0
M  END
>  <Mol_ID> (2,310)
2310

>  <Formula> (2,310)
C18H20N2O4S

>  <MolWeight> (2,310)
360.4274

>  <PCAT_CMPD_ID> (2,310)
WAY-380141

>  <CNC_ID> (2,310)
359447821

>  <transfer_container_id> (2,310)
PTN000000076

>  <COMPOUND_NUMBER> (2,310)
WAY-380141

>  <BAR_CODE_NO> (2,310)
2571430

>  <LOCATION_CODE> (2,310)
PTNCS

>  <AMOUNT_CURRENT> (2,310)
32.7

$$$$
WAY-380162
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    4.2125   -1.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6292   -2.5500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4000   -3.2667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7250   -7.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  8  1  0  0  0  0
  6  3  1  0  0  0  0
  7  3  2  0  0  0  0
  8  6  1  0  0  0  0
  9  5  2  0  0  0  0
 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  1  2  0  0  0  0
 13 11  1  0  0  0  0
 14  2  1  0  0  0  0
 15  4  2  0  0  0  0
 16 12  1  0  0  0  0
 17 16  2  0  0  0  0
 18 10  2  0  0  0  0
 19 13  2  0  0  0  0
 20 13  1  0  0  0  0
 21 14  1  0  0  0  0
 22 15  1  0  0  0  0
 23 22  2  0  0  0  0
 24 20  2  0  0  0  0
 25 19  1  0  0  0  0
 26 24  1  0  0  0  0
 17 10  1  0  0  0  0
 18 23  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,311)
2311

>  <Formula> (2,311)
C22H21NO3

>  <MolWeight> (2,311)
347.40704

>  <PCAT_CMPD_ID> (2,311)
WAY-380162

>  <CNC_ID> (2,311)
359447841

>  <transfer_container_id> (2,311)
PTN000000076

>  <COMPOUND_NUMBER> (2,311)
WAY-380162

>  <BAR_CODE_NO> (2,311)
2571457

>  <LOCATION_CODE> (2,311)
PTNCS

>  <AMOUNT_CURRENT> (2,311)
32.6

$$$$
WAY-380171
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    2.6375   -1.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3125   -0.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6 17  1  0  0  0  0
  7  1  1  0  0  0  0
  8 18  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15  6  2  0  0  0  0
 16  5  1  0  0  0  0
 17  7  1  0  0  0  0
 18 11  1  0  0  0  0
 19 10  2  0  0  0  0
 20 16  2  0  0  0  0
 21 19  1  0  0  0  0
  5  4  2  0  0  0  0
 20 19  1  0  0  0  0
 13 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,312)
2312

>  <Formula> (2,312)
C15H15N3O2S

>  <MolWeight> (2,312)
301.3635

>  <PCAT_CMPD_ID> (2,312)
WAY-380171

>  <CNC_ID> (2,312)
359447850

>  <transfer_container_id> (2,312)
PTN000000076

>  <COMPOUND_NUMBER> (2,312)
WAY-380171

>  <BAR_CODE_NO> (2,312)
2571466

>  <LOCATION_CODE> (2,312)
PTNCS

>  <AMOUNT_CURRENT> (2,312)
32.4

$$$$
WAY-380211
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
    6.5542   -3.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
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 10  6  2  0  0  0  0
 11 20  1  0  0  0  0
 12  8  1  0  0  0  0
 13  8  2  0  0  0  0
 14 15  2  0  0  0  0
 15 13  1  0  0  0  0
 16 12  2  0  0  0  0
 17 14  1  0  0  0  0
 18  7  1  0  0  0  0
 19  7  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22  9  1  0  0  0  0
 23  9  2  0  0  0  0
 24 23  1  0  0  0  0
 25 22  2  0  0  0  0
 26 24  2  0  0  0  0
  2  4  1  0  0  0  0
 21 11  1  0  0  0  0
 16 14  1  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,313)
2313

>  <Formula> (2,313)
C20H18FN3O2

>  <MolWeight> (2,313)
351.3742232

>  <PCAT_CMPD_ID> (2,313)
WAY-380211

>  <CNC_ID> (2,313)
359447889

>  <transfer_container_id> (2,313)
PTN000000076

>  <COMPOUND_NUMBER> (2,313)
WAY-380211

>  <BAR_CODE_NO> (2,313)
2571513

>  <LOCATION_CODE> (2,313)
PTNCS

>  <AMOUNT_CURRENT> (2,313)
32.6

$$$$
WAY-380220
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
    0.0167    0.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  5  1  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14  6  1  0  0  0  0
 15 12  1  0  0  0  0
 16  9  2  0  0  0  0
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 29 27  2  0  0  0  0
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 13  9  1  0  0  0  0
 22 24  2  0  0  0  0
 30 28  2  0  0  0  0
 19 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,314)
2314

>  <Formula> (2,314)
C23H18ClN3O2S

>  <MolWeight> (2,314)
435.92592

>  <PCAT_CMPD_ID> (2,314)
WAY-380220

>  <CNC_ID> (2,314)
359447898

>  <transfer_container_id> (2,314)
PTN000000076

>  <COMPOUND_NUMBER> (2,314)
WAY-380220

>  <BAR_CODE_NO> (2,314)
2571526

>  <LOCATION_CODE> (2,314)
PTNCS

>  <AMOUNT_CURRENT> (2,314)
32.6

$$$$
WAY-380227
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
    0.1808    0.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  2  0  0  0  0
  7 12  2  0  0  0  0
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  9 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
  6  8  1  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,315)
2315

>  <Formula> (2,315)
C13H13NO3S

>  <MolWeight> (2,315)
263.31222

>  <PCAT_CMPD_ID> (2,315)
WAY-380227

>  <CNC_ID> (2,315)
359447905

>  <transfer_container_id> (2,315)
PTN000000076

>  <COMPOUND_NUMBER> (2,315)
WAY-380227

>  <BAR_CODE_NO> (2,315)
2571531

>  <LOCATION_CODE> (2,315)
PTNCS

>  <AMOUNT_CURRENT> (2,315)
32.3

$$$$
WAY-380404
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    0.6250    0.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  2  0  0  0  0
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  9 10  1  0  0  0  0
 10  8  2  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13 15  1  0  0  0  0
 14  5  1  0  0  0  0
 15 16  2  0  0  0  0
 16  8  1  0  0  0  0
 17  7  1  0  0  0  0
 18  6  1  0  0  0  0
 19 21  2  0  0  0  0
 20  6  2  0  0  0  0
 21  7  1  0  0  0  0
 22  9  1  0  0  0  0
 23 13  1  0  0  0  0
 24 22  2  0  0  0  0
 25 23  2  0  0  0  0
 20 19  1  0  0  0  0
  9 13  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,316)
2316

>  <Formula> (2,316)
C19H13ClFNO3

>  <MolWeight> (2,316)
357.7628232

>  <PCAT_CMPD_ID> (2,316)
WAY-380404

>  <CNC_ID> (2,316)
359448082

>  <transfer_container_id> (2,316)
PTN000000076

>  <COMPOUND_NUMBER> (2,316)
WAY-380404

>  <BAR_CODE_NO> (2,316)
2571710

>  <LOCATION_CODE> (2,316)
PTNCS

>  <AMOUNT_CURRENT> (2,316)
32.8

$$$$
WAY-380417
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  9  1  0  0  0  0
 12 17  2  0  0  0  0
 13 12  1  0  0  0  0
 14 11  1  0  0  0  0
 15 11  2  0  0  0  0
 16 14  2  0  0  0  0
 17 15  1  0  0  0  0
 18  2  1  0  0  0  0
 19  8  1  0  0  0  0
 20  8  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
 21 23  1  0  0  0  0
 16 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,317)
2317

>  <Formula> (2,317)
C17H22ClNO4

>  <MolWeight> (2,317)
339.81388

>  <PCAT_CMPD_ID> (2,317)
WAY-380417

>  <CNC_ID> (2,317)
359448095

>  <transfer_container_id> (2,317)
PTN000000076

>  <COMPOUND_NUMBER> (2,317)
WAY-380417

>  <BAR_CODE_NO> (2,317)
2571724

>  <LOCATION_CODE> (2,317)
PTNCS

>  <AMOUNT_CURRENT> (2,317)
32.4

$$$$
WAY-380432
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    0.7430   -1.6507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  8 12  2  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,318)
2318

>  <Formula> (2,318)
C17H15N3O2

>  <MolWeight> (2,318)
293.3199

>  <PCAT_CMPD_ID> (2,318)
WAY-380432

>  <CNC_ID> (2,318)
359448110

>  <transfer_container_id> (2,318)
PTN000000076

>  <COMPOUND_NUMBER> (2,318)
WAY-380432

>  <BAR_CODE_NO> (2,318)
2571798

>  <LOCATION_CODE> (2,318)
PTNCS

>  <AMOUNT_CURRENT> (2,318)
32.8

$$$$
WAY-380433
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 13  9  2  0  0  0  0
 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
 16  4  1  0  0  0  0
 17  7  1  0  0  0  0
 18 10  1  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
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 25 24  1  0  0  0  0
  7  5  1  0  0  0  0
 23 18  2  0  0  0  0
 25 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,319)
2319

>  <Formula> (2,319)
C19H14ClNO4

>  <MolWeight> (2,319)
355.77176

>  <PCAT_CMPD_ID> (2,319)
WAY-380433

>  <CNC_ID> (2,319)
359448111

>  <transfer_container_id> (2,319)
PTN000000076

>  <COMPOUND_NUMBER> (2,319)
WAY-380433

>  <BAR_CODE_NO> (2,319)
2571733

>  <LOCATION_CODE> (2,319)
PTNCS

>  <AMOUNT_CURRENT> (2,319)
32.5

$$$$
WAY-380449
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
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 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  7  8  1  0  0  0  0
 10 12  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,320)
2320

>  <Formula> (2,320)
C18H16N2O3

>  <MolWeight> (2,320)
308.33124

>  <PCAT_CMPD_ID> (2,320)
WAY-380449

>  <CNC_ID> (2,320)
359448126

>  <transfer_container_id> (2,320)
PTN000000076

>  <COMPOUND_NUMBER> (2,320)
WAY-380449

>  <BAR_CODE_NO> (2,320)
2571751

>  <LOCATION_CODE> (2,320)
PTNCS

>  <AMOUNT_CURRENT> (2,320)
32.7

$$$$
WAY-380496
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  7  2  0  0  0  0
  9  8  1  0  0  0  0
 10  5  2  0  0  0  0
 11 14  1  0  0  0  0
 12 18  2  0  0  0  0
 13  7  1  0  0  0  0
 14 13  2  0  0  0  0
 15  6  1  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18 15  1  0  0  0  0
 19 23  2  0  0  0  0
 20 15  2  0  0  0  0
 21 16  1  0  0  0  0
 22 17  1  0  0  0  0
 23 20  1  0  0  0  0
  5  4  1  0  0  0  0
  9 11  2  0  0  0  0
 19 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,321)
2321

>  <Formula> (2,321)
C17H14N2O4

>  <MolWeight> (2,321)
310.30406

>  <PCAT_CMPD_ID> (2,321)
WAY-380496

>  <CNC_ID> (2,321)
359448173

>  <transfer_container_id> (2,321)
PTN000000076

>  <COMPOUND_NUMBER> (2,321)
WAY-380496

>  <BAR_CODE_NO> (2,321)
2571199

>  <LOCATION_CODE> (2,321)
PTNCS

>  <AMOUNT_CURRENT> (2,321)
32.3

$$$$
WAY-380522
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
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  6  4  1  0  0  0  0
  7 16  1  0  0  0  0
  8  5  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  4  2  0  0  0  0
 12  6  1  0  0  0  0
 13  5  2  0  0  0  0
 14 11  1  0  0  0  0
 15  7  2  0  0  0  0
 16  8  1  0  0  0  0
 17  1  1  0  0  0  0
 18 10  1  0  0  0  0
 19 22  1  0  0  0  0
 20 18  2  0  0  0  0
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 23 20  1  0  0  0  0
 24  3  1  0  0  0  0
 25 19  1  0  0  0  0
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 27 25  1  0  0  0  0
 24 26  1  0  0  0  0
 12 14  2  0  0  0  0
 19 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,322)
2322

>  <Formula> (2,322)
C19H20N2O5S

>  <MolWeight> (2,322)
388.4375

>  <PCAT_CMPD_ID> (2,322)
WAY-380522

>  <CNC_ID> (2,322)
359448199

>  <transfer_container_id> (2,322)
PTN000000076

>  <COMPOUND_NUMBER> (2,322)
WAY-380522

>  <BAR_CODE_NO> (2,322)
2571197

>  <LOCATION_CODE> (2,322)
PTNCS

>  <AMOUNT_CURRENT> (2,322)
32.6

$$$$
WAY-380533
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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   16.0000   -3.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  4  1  0  0  0  0
 12  4  2  0  0  0  0
 13 16  1  0  0  0  0
 14  9  1  0  0  0  0
 15 13  1  0  0  0  0
 16 18  2  0  0  0  0
 17 11  2  0  0  0  0
 18 12  1  0  0  0  0
 19  2  1  0  0  0  0
 20  3  1  0  0  0  0
 21 20  2  0  0  0  0
 22  9  1  0  0  0  0
 23 21  1  0  0  0  0
 24 14  1  0  0  0  0
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 27 22  2  0  0  0  0
 28 27  1  0  0  0  0
 16 17  1  0  0  0  0
 14 23  2  0  0  0  0
 28 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,323)
2323

>  <Formula> (2,323)
C21H22N2O4S

>  <MolWeight> (2,323)
398.47538

>  <PCAT_CMPD_ID> (2,323)
WAY-380533

>  <CNC_ID> (2,323)
359448210

>  <transfer_container_id> (2,323)
PTN000000076

>  <COMPOUND_NUMBER> (2,323)
WAY-380533

>  <BAR_CODE_NO> (2,323)
2569056

>  <LOCATION_CODE> (2,323)
PTNCS

>  <AMOUNT_CURRENT> (2,323)
32.8

$$$$
WAY-380536
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 12  8  1  0  0  0  0
 13  9  1  0  0  0  0
 14  2  1  0  0  0  0
 15  2  1  0  0  0  0
 16  1  2  0  0  0  0
 17  3  2  0  0  0  0
 18 14  1  0  0  0  0
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 20 23  2  0  0  0  0
 21  7  2  0  0  0  0
 22  7  1  0  0  0  0
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M  END
>  <Mol_ID> (2,324)
2324

>  <Formula> (2,324)
C21H22N2O5

>  <MolWeight> (2,324)
382.40978

>  <PCAT_CMPD_ID> (2,324)
WAY-380536

>  <CNC_ID> (2,324)
359448213

>  <transfer_container_id> (2,324)
PTN000000076

>  <COMPOUND_NUMBER> (2,324)
WAY-380536

>  <BAR_CODE_NO> (2,324)
2569060

>  <LOCATION_CODE> (2,324)
PTNCS

>  <AMOUNT_CURRENT> (2,324)
33

$$$$
WAY-380838
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
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 12 13  1  0  0  0  0
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 18 20  2  0  0  0  0
 19 21  1  0  0  0  0
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 22 24  1  0  0  0  0
  5  7  1  0  0  0  0
  9 11  2  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,325)
2325

>  <Formula> (2,325)
C17H11Cl2NO4

>  <MolWeight> (2,325)
364.17954

>  <PCAT_CMPD_ID> (2,325)
WAY-380838

>  <CNC_ID> (2,325)
359448513

>  <transfer_container_id> (2,325)
PTN000000076

>  <COMPOUND_NUMBER> (2,325)
WAY-380838

>  <BAR_CODE_NO> (2,325)
2568308

>  <LOCATION_CODE> (2,325)
PTNCS

>  <AMOUNT_CURRENT> (2,325)
32.4

$$$$
WAY-381221
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  2  0  0  0  0
 14  1  1  0  0  0  0
 15 21  1  0  0  0  0
 16  9  1  0  0  0  0
 17  8  1  0  0  0  0
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 19  9  1  0  0  0  0
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  5  4  1  0  0  0  0
 27 28  1  0  0  0  0
 20 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,326)
2326

>  <Formula> (2,326)
C20H17BrN2O4S

>  <MolWeight> (2,326)
461.32898

>  <PCAT_CMPD_ID> (2,326)
WAY-381221

>  <CNC_ID> (2,326)
359448896

>  <transfer_container_id> (2,326)
PTN000000076

>  <COMPOUND_NUMBER> (2,326)
WAY-381221

>  <BAR_CODE_NO> (2,326)
2568927

>  <LOCATION_CODE> (2,326)
PTNCS

>  <AMOUNT_CURRENT> (2,326)
32.1

$$$$
WAY-381413
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 13  7  2  0  0  0  0
 14  5  2  0  0  0  0
 15  8  1  0  0  0  0
 16  8  2  0  0  0  0
 17 10  1  0  0  0  0
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 21  3  1  0  0  0  0
 22  7  1  0  0  0  0
 23 13  1  0  0  0  0
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 13 17  1  0  0  0  0
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  6  2  1  0  0  0  0
  5  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,327)
2327

>  <Formula> (2,327)
C22H21NO4

>  <MolWeight> (2,327)
363.40644

>  <PCAT_CMPD_ID> (2,327)
WAY-381413

>  <CNC_ID> (2,327)
359449087

>  <transfer_container_id> (2,327)
PTN000000076

>  <COMPOUND_NUMBER> (2,327)
WAY-381413

>  <BAR_CODE_NO> (2,327)
2571874

>  <LOCATION_CODE> (2,327)
PTNCS

>  <AMOUNT_CURRENT> (2,327)
32.6

$$$$
WAY-381441
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 29 28  1  0  0  0  0
 12  5  2  0  0  0  0
 21 26  1  0  0  0  0
 27 29  1  0  0  0  0
M  END
>  <Mol_ID> (2,328)
2328

>  <Formula> (2,328)
C21H27N3O4S

>  <MolWeight> (2,328)
417.52178

>  <PCAT_CMPD_ID> (2,328)
WAY-381441

>  <CNC_ID> (2,328)
359449115

>  <transfer_container_id> (2,328)
PTN000000076

>  <COMPOUND_NUMBER> (2,328)
WAY-381441

>  <BAR_CODE_NO> (2,328)
2571942

>  <LOCATION_CODE> (2,328)
PTNCS

>  <AMOUNT_CURRENT> (2,328)
32.7

$$$$
WAY-381505
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7 15  1  0  0  0  0
  8  4  1  0  0  0  0
  9  8  2  0  0  0  0
 10  7  1  0  0  0  0
 11  2  2  0  0  0  0
 12  3  2  0  0  0  0
 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 10  2  0  0  0  0
 18 17  1  0  0  0  0
 19 10  1  0  0  0  0
 20  8  1  0  0  0  0
 21  9  1  0  0  0  0
 22 17  1  0  0  0  0
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 25 26  1  0  0  0  0
 26 20  2  0  0  0  0
 27 24  1  0  0  0  0
  9  5  1  0  0  0  0
  7 16  1  0  0  0  0
 25 21  2  0  0  0  0
 22 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,329)
2329

>  <Formula> (2,329)
C21H20N2O4

>  <MolWeight> (2,329)
364.3945

>  <PCAT_CMPD_ID> (2,329)
WAY-381505

>  <CNC_ID> (2,329)
359449176

>  <transfer_container_id> (2,329)
PTN000000076

>  <COMPOUND_NUMBER> (2,329)
WAY-381505

>  <BAR_CODE_NO> (2,329)
2571904

>  <LOCATION_CODE> (2,329)
PTNCS

>  <AMOUNT_CURRENT> (2,329)
32.2

$$$$
WAY-381509
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   12.0917  -14.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7792  -14.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3 11  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  5  1  0  0  0  0
  9  2  1  0  0  0  0
 10  7  2  0  0  0  0
 11 17  1  0  0  0  0
 12  6  2  0  0  0  0
 13  3  2  0  0  0  0
 14 13  1  0  0  0  0
 15  6  1  0  0  0  0
 16 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 11  2  0  0  0  0
 19  8  1  0  0  0  0
 20 10  1  0  0  0  0
 21 20  1  0  0  0  0
  4 10  1  0  0  0  0
 16  9  2  0  0  0  0
 14  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,330)
2330

>  <Formula> (2,330)
C14H11ClN2OS3

>  <MolWeight> (2,330)
354.89794

>  <PCAT_CMPD_ID> (2,330)
WAY-381509

>  <CNC_ID> (2,330)
359449180

>  <transfer_container_id> (2,330)
PTN000000076

>  <COMPOUND_NUMBER> (2,330)
WAY-381509

>  <BAR_CODE_NO> (2,330)
2571918

>  <LOCATION_CODE> (2,330)
PTNCS

>  <AMOUNT_CURRENT> (2,330)
32.2

$$$$
WAY-381510
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
    2.1000   -0.5292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  8  2  0  0  0  0
 11  8  1  0  0  0  0
 12 11  2  0  0  0  0
 13 10  1  0  0  0  0
 14  9  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
  7  4  1  0  0  0  0
  9 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,331)
2331

>  <Formula> (2,331)
C11H12N2O2S

>  <MolWeight> (2,331)
236.29018

>  <PCAT_CMPD_ID> (2,331)
WAY-381510

>  <CNC_ID> (2,331)
359449181

>  <transfer_container_id> (2,331)
PTN000000076

>  <COMPOUND_NUMBER> (2,331)
WAY-381510

>  <BAR_CODE_NO> (2,331)
2571919

>  <LOCATION_CODE> (2,331)
PTNCS

>  <AMOUNT_CURRENT> (2,331)
32.9

$$$$
WAY-381545
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    4.4792   -1.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12  4  1  0  0  0  0
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 27 20  1  0  0  0  0
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  3  4  2  0  0  0  0
 16 18  2  0  0  0  0
 29 27  2  0  0  0  0
 30 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,332)
2332

>  <Formula> (2,332)
C25H18N2O3

>  <MolWeight> (2,332)
394.42202

>  <PCAT_CMPD_ID> (2,332)
WAY-381545

>  <CNC_ID> (2,332)
359449216

>  <transfer_container_id> (2,332)
PTN000000076

>  <COMPOUND_NUMBER> (2,332)
WAY-381545

>  <BAR_CODE_NO> (2,332)
2572283

>  <LOCATION_CODE> (2,332)
PTNCS

>  <AMOUNT_CURRENT> (2,332)
32.6

$$$$
WAY-381546
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,333)
2333

>  <Formula> (2,333)
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>  <MolWeight> (2,333)
360.45384

>  <PCAT_CMPD_ID> (2,333)
WAY-381546

>  <CNC_ID> (2,333)
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>  <transfer_container_id> (2,333)
PTN000000076

>  <COMPOUND_NUMBER> (2,333)
WAY-381546

>  <BAR_CODE_NO> (2,333)
2572281

>  <LOCATION_CODE> (2,333)
PTNCS

>  <AMOUNT_CURRENT> (2,333)
32.4

$$$$
WAY-381745
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,334)
2334

>  <Formula> (2,334)
C14H9Cl2NO3

>  <MolWeight> (2,334)
310.13216

>  <PCAT_CMPD_ID> (2,334)
WAY-381745

>  <CNC_ID> (2,334)
359449411

>  <transfer_container_id> (2,334)
PTN000000076

>  <COMPOUND_NUMBER> (2,334)
WAY-381745

>  <BAR_CODE_NO> (2,334)
2572991

>  <LOCATION_CODE> (2,334)
PTNCS

>  <AMOUNT_CURRENT> (2,334)
32.5

$$$$
WAY-381755
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,335)
2335

>  <Formula> (2,335)
C22H21NO3

>  <MolWeight> (2,335)
347.40704

>  <PCAT_CMPD_ID> (2,335)
WAY-381755

>  <CNC_ID> (2,335)
359449421

>  <transfer_container_id> (2,335)
PTN000000076

>  <COMPOUND_NUMBER> (2,335)
WAY-381755

>  <BAR_CODE_NO> (2,335)
2572135

>  <LOCATION_CODE> (2,335)
PTNCS

>  <AMOUNT_CURRENT> (2,335)
32.8

$$$$
WAY-381781
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 14 13  2  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,336)
2336

>  <Formula> (2,336)
C16H13BrN4S2

>  <MolWeight> (2,336)
405.33522

>  <PCAT_CMPD_ID> (2,336)
WAY-381781

>  <CNC_ID> (2,336)
359449445

>  <transfer_container_id> (2,336)
PTN000000076

>  <COMPOUND_NUMBER> (2,336)
WAY-381781

>  <BAR_CODE_NO> (2,336)
2572188

>  <LOCATION_CODE> (2,336)
PTNCS

>  <AMOUNT_CURRENT> (2,336)
32.2

$$$$
WAY-381807
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,337)
2337

>  <Formula> (2,337)
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>  <MolWeight> (2,337)
349.37986

>  <PCAT_CMPD_ID> (2,337)
WAY-381807

>  <CNC_ID> (2,337)
359449470

>  <transfer_container_id> (2,337)
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>  <COMPOUND_NUMBER> (2,337)
WAY-381807

>  <BAR_CODE_NO> (2,337)
2572206

>  <LOCATION_CODE> (2,337)
PTNCS

>  <AMOUNT_CURRENT> (2,337)
32.2

$$$$
WAY-381953
csChFnd80/10111816222D

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 13 10  1  0  0  0  0
 14  6  2  0  0  0  0
 15 11  1  0  0  0  0
 16 10  2  0  0  0  0
 17 13  1  0  0  0  0
 18  4  1  0  0  0  0
 19 12  2  0  0  0  0
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 23  9  1  0  0  0  0
 24 23  1  0  0  0  0
  9  8  2  0  0  0  0
  6  4  1  0  0  0  0
 20 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,338)
2338

>  <Formula> (2,338)
C17H16N2O2S3

>  <MolWeight> (2,338)
376.51614

>  <PCAT_CMPD_ID> (2,338)
WAY-381953

>  <CNC_ID> (2,338)
359449608

>  <transfer_container_id> (2,338)
PTN000000076

>  <COMPOUND_NUMBER> (2,338)
WAY-381953

>  <BAR_CODE_NO> (2,338)
2572391

>  <LOCATION_CODE> (2,338)
PTNCS

>  <AMOUNT_CURRENT> (2,338)
32.7

$$$$
WAY-381959
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
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  3  7  2  0  0  0  0
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  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,339)
2339

>  <Formula> (2,339)
C16H14N2O2S2

>  <MolWeight> (2,339)
330.42456

>  <PCAT_CMPD_ID> (2,339)
WAY-381959

>  <CNC_ID> (2,339)
359449615

>  <transfer_container_id> (2,339)
PTN000000076

>  <COMPOUND_NUMBER> (2,339)
WAY-381959

>  <BAR_CODE_NO> (2,339)
2572382

>  <LOCATION_CODE> (2,339)
PTNCS

>  <AMOUNT_CURRENT> (2,339)
32.2

$$$$
WAY-382330
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  4  1  0  0  0  0
  6  7  1  0  0  0  0
  7  3  2  0  0  0  0
  8  1  2  0  0  0  0
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 10 19  1  0  0  0  0
 11 14  1  0  0  0  0
 12  2  1  0  0  0  0
 13  2  1  0  0  0  0
 14 15  2  0  0  0  0
 15  5  1  0  0  0  0
 16  4  2  0  0  0  0
 17 20  1  0  0  0  0
 18 12  1  0  0  0  0
 19 13  1  0  0  0  0
 20 22  2  0  0  0  0
 21 11  1  0  0  0  0
 22 15  1  0  0  0  0
 23  3  1  0  0  0  0
 24 10  1  0  0  0  0
 25 26  1  0  0  0  0
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 27 17  1  0  0  0  0
 18 10  1  0  0  0  0
 25  6  2  0  0  0  0
 11 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,340)
2340

>  <Formula> (2,340)
C19H22FN3O3S

>  <MolWeight> (2,340)
391.4596832

>  <PCAT_CMPD_ID> (2,340)
WAY-382330

>  <CNC_ID> (2,340)
359449977

>  <transfer_container_id> (2,340)
PTN000000076

>  <COMPOUND_NUMBER> (2,340)
WAY-382330

>  <BAR_CODE_NO> (2,340)
2572963

>  <LOCATION_CODE> (2,340)
PTNCS

>  <AMOUNT_CURRENT> (2,340)
32.3

$$$$
WAY-382098
csChFnd80/10111816222D

 28 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
 15  8  2  0  0  0  0
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 18  1  1  0  0  0  0
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 22 13  2  0  0  0  0
 23  8  1  0  0  0  0
 24  6  1  0  0  0  0
 25 14  1  0  0  0  0
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 27 13  1  0  0  0  0
 28 25  1  0  0  0  0
  6  3  1  0  0  0  0
 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,341)
2341

>  <Formula> (2,341)
C18H16ClF3N2O3S

>  <MolWeight> (2,341)
432.8444496

>  <PCAT_CMPD_ID> (2,341)
WAY-382098

>  <CNC_ID> (2,341)
359449747

>  <transfer_container_id> (2,341)
PTN000000076

>  <COMPOUND_NUMBER> (2,341)
WAY-382098

>  <BAR_CODE_NO> (2,341)
2572566

>  <LOCATION_CODE> (2,341)
PTNCS

>  <AMOUNT_CURRENT> (2,341)
32.7

$$$$
WAY-382195
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  8  9  1  0  0  0  0
 10 13  2  0  0  0  0
 16 18  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,342)
2342

>  <Formula> (2,342)
C18H14FN5O2S

>  <MolWeight> (2,342)
383.3994632

>  <PCAT_CMPD_ID> (2,342)
WAY-382195

>  <CNC_ID> (2,342)
359449843

>  <transfer_container_id> (2,342)
PTN000000076

>  <COMPOUND_NUMBER> (2,342)
WAY-382195

>  <BAR_CODE_NO> (2,342)
2572854

>  <LOCATION_CODE> (2,342)
PTNCS

>  <AMOUNT_CURRENT> (2,342)
32.4

$$$$
WAY-382262
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  9  2  0  0  0  0
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 14  1  1  0  0  0  0
 15  3  2  0  0  0  0
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 21  6  2  0  0  0  0
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 17 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,343)
2343

>  <Formula> (2,343)
C21H16N4OS2

>  <MolWeight> (2,343)
404.50794

>  <PCAT_CMPD_ID> (2,343)
WAY-382262

>  <CNC_ID> (2,343)
359449909

>  <transfer_container_id> (2,343)
PTN000000076

>  <COMPOUND_NUMBER> (2,343)
WAY-382262

>  <BAR_CODE_NO> (2,343)
2572647

>  <LOCATION_CODE> (2,343)
PTNCS

>  <AMOUNT_CURRENT> (2,343)
32.9

$$$$
WAY-312904
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  5 10  2  0  0  0  0
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 10 12  1  0  0  0  0
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 19 22  1  0  0  0  0
  5  7  1  0  0  0  0
 18 21  2  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,344)
2344

>  <Formula> (2,344)
C18H15NOS2

>  <MolWeight> (2,344)
325.4478

>  <PCAT_CMPD_ID> (2,344)
WAY-312904

>  <CNC_ID> (2,344)
359327941

>  <transfer_container_id> (2,344)
PTN000000067

>  <COMPOUND_NUMBER> (2,344)
WAY-312904

>  <BAR_CODE_NO> (2,344)
3917634

>  <LOCATION_CODE> (2,344)
PTNCS

>  <AMOUNT_CURRENT> (2,344)
33.1

$$$$
WAY-312637
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  1  4  1  0  0  0  0
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  6 10  1  0  0  0  0
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 11 13  1  0  0  0  0
 11 14  2  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  6  8  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,345)
2345

>  <Formula> (2,345)
C13H19N3O4S

>  <MolWeight> (2,345)
313.37266

>  <PCAT_CMPD_ID> (2,345)
WAY-312637

>  <CNC_ID> (2,345)
359327674

>  <transfer_container_id> (2,345)
PTN000000067

>  <COMPOUND_NUMBER> (2,345)
WAY-312637

>  <BAR_CODE_NO> (2,345)
3917297

>  <LOCATION_CODE> (2,345)
PTNCS

>  <AMOUNT_CURRENT> (2,345)
33.5

$$$$
WAY-345227
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  2  1  0  0  0  0
 12  4  1  0  0  0  0
 13  4  2  0  0  0  0
 14  9  2  0  0  0  0
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 24  5  2  0  0  0  0
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 22 18  2  0  0  0  0
 30 29  2  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,346)
2346

>  <Formula> (2,346)
C22H14F3N3OS

>  <MolWeight> (2,346)
425.4262696

>  <PCAT_CMPD_ID> (2,346)
WAY-345227

>  <CNC_ID> (2,346)
359320529

>  <transfer_container_id> (2,346)
PTN000000065

>  <COMPOUND_NUMBER> (2,346)
WAY-345227

>  <BAR_CODE_NO> (2,346)
2555720

>  <LOCATION_CODE> (2,346)
PTNCS

>  <AMOUNT_CURRENT> (2,346)
33

$$$$
WAY-311227
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 21 24  1  0  0  0  0
  7  8  1  0  0  0  0
 11 13  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,347)
2347

>  <Formula> (2,347)
C17H16N4O2S

>  <MolWeight> (2,347)
340.39954

>  <PCAT_CMPD_ID> (2,347)
WAY-311227

>  <CNC_ID> (2,347)
359314968

>  <transfer_container_id> (2,347)
PTN000000065

>  <COMPOUND_NUMBER> (2,347)
WAY-311227

>  <BAR_CODE_NO> (2,347)
3915597

>  <LOCATION_CODE> (2,347)
PTNCS

>  <AMOUNT_CURRENT> (2,347)
33.6

$$$$
WAY-311095
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11 13  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,348)
2348

>  <Formula> (2,348)
C18H19N5OS

>  <MolWeight> (2,348)
353.44136

>  <PCAT_CMPD_ID> (2,348)
WAY-311095

>  <CNC_ID> (2,348)
359314837

>  <transfer_container_id> (2,348)
PTN000000065

>  <COMPOUND_NUMBER> (2,348)
WAY-311095

>  <BAR_CODE_NO> (2,348)
3915443

>  <LOCATION_CODE> (2,348)
PTNCS

>  <AMOUNT_CURRENT> (2,348)
33.6

$$$$
WAY-344003
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 12  5  1  0  0  0  0
 13  5  1  0  0  0  0
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 25  4  2  0  0  0  0
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  4  8  1  0  0  0  0
 13  9  2  0  0  0  0
 31 32  2  0  0  0  0
 11  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,349)
2349

>  <Formula> (2,349)
C25H23NO6

>  <MolWeight> (2,349)
433.45322

>  <PCAT_CMPD_ID> (2,349)
WAY-344003

>  <CNC_ID> (2,349)
359319341

>  <transfer_container_id> (2,349)
PTN000000065

>  <COMPOUND_NUMBER> (2,349)
WAY-344003

>  <BAR_CODE_NO> (2,349)
2554202

>  <LOCATION_CODE> (2,349)
PTNCS

>  <AMOUNT_CURRENT> (2,349)
32.3

$$$$
WAY-344678-A
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  6  2  0  0  0  0
 12  8  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  1  0  0  0  0
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 17 10  2  0  0  0  0
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  4  2  1  0  0  0  0
 18 21  1  0  0  0  0
 20 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,350)
2350

>  <Formula> (2,350)
C16H22N4S

>  <MolWeight> (2,350)
302.43768

>  <PCAT_CMPD_ID> (2,350)
WAY-344678-A

>  <CNC_ID> (2,350)
359319990

>  <transfer_container_id> (2,350)
PTN000000065

>  <COMPOUND_NUMBER> (2,350)
WAY-344678-A

>  <BAR_CODE_NO> (2,350)
2554974

>  <LOCATION_CODE> (2,350)
PTNCS

>  <AMOUNT_CURRENT> (2,350)
32.2

$$$$
WAY-313301
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  6  9  1  0  0  0  0
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 22 25  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,351)
2351

>  <Formula> (2,351)
C22H14N4OS

>  <MolWeight> (2,351)
382.43776

>  <PCAT_CMPD_ID> (2,351)
WAY-313301

>  <CNC_ID> (2,351)
359328337

>  <transfer_container_id> (2,351)
PTN000000067

>  <COMPOUND_NUMBER> (2,351)
WAY-313301

>  <BAR_CODE_NO> (2,351)
3918164

>  <LOCATION_CODE> (2,351)
PTNCS

>  <AMOUNT_CURRENT> (2,351)
33.2

$$$$
WAY-116048
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,352)
2352

>  <Formula> (2,352)
C13H12N2O4S

>  <MolWeight> (2,352)
292.31038

>  <PCAT_CMPD_ID> (2,352)
WAY-116048

>  <CNC_ID> (2,352)
359326821

>  <transfer_container_id> (2,352)
PTN000000067

>  <COMPOUND_NUMBER> (2,352)
WAY-116048

>  <BAR_CODE_NO> (2,352)
3918199

>  <LOCATION_CODE> (2,352)
PTNCS

>  <AMOUNT_CURRENT> (2,352)
33.5

$$$$
WAY-312722
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,353)
2353

>  <Formula> (2,353)
C21H14N2O4S2

>  <MolWeight> (2,353)
422.47686

>  <PCAT_CMPD_ID> (2,353)
WAY-312722

>  <CNC_ID> (2,353)
359327759

>  <transfer_container_id> (2,353)
PTN000000067

>  <COMPOUND_NUMBER> (2,353)
WAY-312722

>  <BAR_CODE_NO> (2,353)
3917410

>  <LOCATION_CODE> (2,353)
PTNCS

>  <AMOUNT_CURRENT> (2,353)
33.3

$$$$
WAY-313140
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  7  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,354)
2354

>  <Formula> (2,354)
C17H9BrN2O3S

>  <MolWeight> (2,354)
401.23396

>  <PCAT_CMPD_ID> (2,354)
WAY-313140

>  <CNC_ID> (2,354)
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>  <transfer_container_id> (2,354)
PTN000000067

>  <COMPOUND_NUMBER> (2,354)
WAY-313140

>  <BAR_CODE_NO> (2,354)
3917943

>  <LOCATION_CODE> (2,354)
PTNCS

>  <AMOUNT_CURRENT> (2,354)
33.5

$$$$
WAY-311608
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
 14 16  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,355)
2355

>  <Formula> (2,355)
C16H15N3OS

>  <MolWeight> (2,355)
297.3748

>  <PCAT_CMPD_ID> (2,355)
WAY-311608

>  <CNC_ID> (2,355)
359315349

>  <transfer_container_id> (2,355)
PTN000000065

>  <COMPOUND_NUMBER> (2,355)
WAY-311608

>  <BAR_CODE_NO> (2,355)
3916035

>  <LOCATION_CODE> (2,355)
PTNCS

>  <AMOUNT_CURRENT> (2,355)
33.8

$$$$
WAY-313270
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,356)
2356

>  <Formula> (2,356)
C20H15N3O2

>  <MolWeight> (2,356)
329.352

>  <PCAT_CMPD_ID> (2,356)
WAY-313270

>  <CNC_ID> (2,356)
359328306

>  <transfer_container_id> (2,356)
PTN000000067

>  <COMPOUND_NUMBER> (2,356)
WAY-313270

>  <BAR_CODE_NO> (2,356)
3918120

>  <LOCATION_CODE> (2,356)
PTNCS

>  <AMOUNT_CURRENT> (2,356)
33.5

$$$$
WAY-311580
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  6  7  1  0  0  0  0
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M  END
>  <Mol_ID> (2,357)
2357

>  <Formula> (2,357)
C14H14N2O3S

>  <MolWeight> (2,357)
290.33756

>  <PCAT_CMPD_ID> (2,357)
WAY-311580

>  <CNC_ID> (2,357)
359315321

>  <transfer_container_id> (2,357)
PTN000000065

>  <COMPOUND_NUMBER> (2,357)
WAY-311580

>  <BAR_CODE_NO> (2,357)
3915996

>  <LOCATION_CODE> (2,357)
PTNCS

>  <AMOUNT_CURRENT> (2,357)
33.6

$$$$
WAY-310286
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  7 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9  3  2  0  0  0  0
 10  7  1  0  0  0  0
 11  6  1  0  0  0  0
 12  5  2  0  0  0  0
 13  7  2  0  0  0  0
 14 10  2  0  0  0  0
 15 10  1  0  0  0  0
 16  5  1  0  0  0  0
 17 15  2  0  0  0  0
 18 14  1  0  0  0  0
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 20  4  1  0  0  0  0
 21  9  1  0  0  0  0
 22 19  1  0  0  0  0
  4  8  2  0  0  0  0
 19 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,358)
2358

>  <Formula> (2,358)
C17H18N2O2S

>  <MolWeight> (2,358)
314.40202

>  <PCAT_CMPD_ID> (2,358)
WAY-310286

>  <CNC_ID> (2,358)
359314027

>  <transfer_container_id> (2,358)
PTN000000065

>  <COMPOUND_NUMBER> (2,358)
WAY-310286

>  <BAR_CODE_NO> (2,358)
3914481

>  <LOCATION_CODE> (2,358)
PTNCS

>  <AMOUNT_CURRENT> (2,358)
33.4

$$$$
WAY-116748
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  4  2  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  6  2  0  0  0  0
 12  9  1  0  0  0  0
 13 16  1  0  0  0  0
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 15 12  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
 19  7  1  0  0  0  0
 20  8  1  0  0  0  0
 21 18  1  0  0  0  0
 22 21  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  2  0  0  0  0
  4  3  1  0  0  0  0
 20 23  2  0  0  0  0
 17 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,359)
2359

>  <Formula> (2,359)
C18H18N2O3S

>  <MolWeight> (2,359)
342.41212

>  <PCAT_CMPD_ID> (2,359)
WAY-116748

>  <CNC_ID> (2,359)
359326823

>  <transfer_container_id> (2,359)
PTN000000067

>  <COMPOUND_NUMBER> (2,359)
WAY-116748

>  <BAR_CODE_NO> (2,359)
3918009

>  <LOCATION_CODE> (2,359)
PTNCS

>  <AMOUNT_CURRENT> (2,359)
33.8

$$$$
WAY-333617
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 10  2  0  0  0  0
 12  5  1  0  0  0  0
 13 12  1  0  0  0  0
 14  3  2  0  0  0  0
 15  3  2  0  0  0  0
 16  2  2  0  0  0  0
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 18  4  2  0  0  0  0
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  8 13  1  0  0  0  0
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 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,360)
2360

>  <Formula> (2,360)
C21H17NO5S

>  <MolWeight> (2,360)
395.42838

>  <PCAT_CMPD_ID> (2,360)
WAY-333617

>  <CNC_ID> (2,360)
359318851

>  <transfer_container_id> (2,360)
PTN000000065

>  <COMPOUND_NUMBER> (2,360)
WAY-333617

>  <BAR_CODE_NO> (2,360)
2555729

>  <LOCATION_CODE> (2,360)
PTNCS

>  <AMOUNT_CURRENT> (2,360)
32.5

$$$$
WAY-310735
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 23 26  2  0  0  0  0
 28 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,361)
2361

>  <Formula> (2,361)
C20H19F3N4O3

>  <MolWeight> (2,361)
420.3850696

>  <PCAT_CMPD_ID> (2,361)
WAY-310735

>  <CNC_ID> (2,361)
359314476

>  <transfer_container_id> (2,361)
PTN000000065

>  <COMPOUND_NUMBER> (2,361)
WAY-310735

>  <BAR_CODE_NO> (2,361)
3914996

>  <LOCATION_CODE> (2,361)
PTNCS

>  <AMOUNT_CURRENT> (2,361)
33.1

$$$$
WAY-312690
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,362)
2362

>  <Formula> (2,362)
C17H20N2O2S3

>  <MolWeight> (2,362)
380.5479

>  <PCAT_CMPD_ID> (2,362)
WAY-312690

>  <CNC_ID> (2,362)
359327727

>  <transfer_container_id> (2,362)
PTN000000067

>  <COMPOUND_NUMBER> (2,362)
WAY-312690

>  <BAR_CODE_NO> (2,362)
3917359

>  <LOCATION_CODE> (2,362)
PTNCS

>  <AMOUNT_CURRENT> (2,362)
33.8

$$$$
WAY-311269
csChFnd80/10111816222D

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 20 22  1  0  0  0  0
 26 28  2  0  0  0  0
M  END
>  <Mol_ID> (2,363)
2363

>  <Formula> (2,363)
C21H19N5O3

>  <MolWeight> (2,363)
389.40726

>  <PCAT_CMPD_ID> (2,363)
WAY-311269

>  <CNC_ID> (2,363)
359315010

>  <transfer_container_id> (2,363)
PTN000000065

>  <COMPOUND_NUMBER> (2,363)
WAY-311269

>  <BAR_CODE_NO> (2,363)
3915639

>  <LOCATION_CODE> (2,363)
PTNCS

>  <AMOUNT_CURRENT> (2,363)
33.5

$$$$
WAY-312785
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,364)
2364

>  <Formula> (2,364)
C16H21N3O2S

>  <MolWeight> (2,364)
319.42184

>  <PCAT_CMPD_ID> (2,364)
WAY-312785

>  <CNC_ID> (2,364)
359327822

>  <transfer_container_id> (2,364)
PTN000000067

>  <COMPOUND_NUMBER> (2,364)
WAY-312785

>  <BAR_CODE_NO> (2,364)
3917493

>  <LOCATION_CODE> (2,364)
PTNCS

>  <AMOUNT_CURRENT> (2,364)
33.1

$$$$
CL-393965
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,365)
2365

>  <Formula> (2,365)
C11H10N4OS

>  <MolWeight> (2,365)
246.2883

>  <PCAT_CMPD_ID> (2,365)
CL-393965

>  <CNC_ID> (2,365)
359313580

>  <transfer_container_id> (2,365)
PTN000000065

>  <COMPOUND_NUMBER> (2,365)
CL-393965

>  <BAR_CODE_NO> (2,365)
3914854

>  <LOCATION_CODE> (2,365)
PTNCS

>  <AMOUNT_CURRENT> (2,365)
30.5

$$$$
WAY-343900
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 23 20  2  0  0  0  0
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  8  5  1  0  0  0  0
 12 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,366)
2366

>  <Formula> (2,366)
C14H12Cl2N2O5S

>  <MolWeight> (2,366)
391.22648

>  <PCAT_CMPD_ID> (2,366)
WAY-343900

>  <CNC_ID> (2,366)
359319240

>  <transfer_container_id> (2,366)
PTN000000065

>  <COMPOUND_NUMBER> (2,366)
WAY-343900

>  <BAR_CODE_NO> (2,366)
2553995

>  <LOCATION_CODE> (2,366)
PTNCS

>  <AMOUNT_CURRENT> (2,366)
32.7

$$$$
WAY-343891
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 10 18  1  0  0  0  0
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 12  2  2  0  0  0  0
 13  4  2  0  0  0  0
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 16  1  1  0  0  0  0
 17  7  1  0  0  0  0
 18 24  1  0  0  0  0
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 20  9  2  0  0  0  0
 21  7  1  0  0  0  0
 22 20  1  0  0  0  0
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 24 16  1  0  0  0  0
  8  5  1  0  0  0  0
 17 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,367)
2367

>  <Formula> (2,367)
C14H12Cl2N2O5S

>  <MolWeight> (2,367)
391.22648

>  <PCAT_CMPD_ID> (2,367)
WAY-343891

>  <CNC_ID> (2,367)
359319232

>  <transfer_container_id> (2,367)
PTN000000065

>  <COMPOUND_NUMBER> (2,367)
WAY-343891

>  <BAR_CODE_NO> (2,367)
2553987

>  <LOCATION_CODE> (2,367)
PTNCS

>  <AMOUNT_CURRENT> (2,367)
32.1

$$$$
WAY-311964
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  5  1  0  0  0  0
 12  2  2  0  0  0  0
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 15  4  1  0  0  0  0
 16 11  1  0  0  0  0
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 18  7  1  0  0  0  0
 19  7  1  0  0  0  0
 20  8  2  0  0  0  0
 21  9  2  0  0  0  0
 22 15  1  0  0  0  0
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 23 24  1  0  0  0  0
  8  9  1  0  0  0  0
  4  5  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,368)
2368

>  <Formula> (2,368)
C20H23N3O2S

>  <MolWeight> (2,368)
369.48052

>  <PCAT_CMPD_ID> (2,368)
WAY-311964

>  <CNC_ID> (2,368)
359315705

>  <transfer_container_id> (2,368)
PTN000000065

>  <COMPOUND_NUMBER> (2,368)
WAY-311964

>  <BAR_CODE_NO> (2,368)
3916509

>  <LOCATION_CODE> (2,368)
PTNCS

>  <AMOUNT_CURRENT> (2,368)
33.4

$$$$
WAY-344265
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  2  2  0  0  0  0
 12  6  1  0  0  0  0
 13  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15 12  1  0  0  0  0
 16  5  2  0  0  0  0
 17  7  2  0  0  0  0
 18 10  1  0  0  0  0
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 20 10  1  0  0  0  0
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 22 15  2  0  0  0  0
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 27 25  2  0  0  0  0
  5  7  1  0  0  0  0
 24 23  2  0  0  0  0
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M  END
>  <Mol_ID> (2,369)
2369

>  <Formula> (2,369)
C21H23N3O2S

>  <MolWeight> (2,369)
381.49122

>  <PCAT_CMPD_ID> (2,369)
WAY-344265

>  <CNC_ID> (2,369)
359319603

>  <transfer_container_id> (2,369)
PTN000000065

>  <COMPOUND_NUMBER> (2,369)
WAY-344265

>  <BAR_CODE_NO> (2,369)
2554440

>  <LOCATION_CODE> (2,369)
PTNCS

>  <AMOUNT_CURRENT> (2,369)
32.8

$$$$
WAY-312887
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12 14  1  0  0  0  0
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M  END
>  <Mol_ID> (2,370)
2370

>  <Formula> (2,370)
C18H13Cl2NO4S

>  <MolWeight> (2,370)
410.27112

>  <PCAT_CMPD_ID> (2,370)
WAY-312887

>  <CNC_ID> (2,370)
359327924

>  <transfer_container_id> (2,370)
PTN000000067

>  <COMPOUND_NUMBER> (2,370)
WAY-312887

>  <BAR_CODE_NO> (2,370)
3917616

>  <LOCATION_CODE> (2,370)
PTNCS

>  <AMOUNT_CURRENT> (2,370)
33.7

$$$$
WAY-312609
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 26 28  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  1  0  0  0  0
 18 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,371)
2371

>  <Formula> (2,371)
C19H20N4O5

>  <MolWeight> (2,371)
384.3859

>  <PCAT_CMPD_ID> (2,371)
WAY-312609

>  <CNC_ID> (2,371)
359327646

>  <transfer_container_id> (2,371)
PTN000000067

>  <COMPOUND_NUMBER> (2,371)
WAY-312609

>  <BAR_CODE_NO> (2,371)
3917269

>  <LOCATION_CODE> (2,371)
PTNCS

>  <AMOUNT_CURRENT> (2,371)
33.5

$$$$
WAY-344905
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  2  1  0  0  0  0
 14  2  1  0  0  0  0
 15 18  1  0  0  0  0
 16 14  1  0  0  0  0
 17 13  1  0  0  0  0
 18  8  1  0  0  0  0
 19  8  2  0  0  0  0
 20  9  2  0  0  0  0
 21  9  1  0  0  0  0
 22 24  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  2  0  0  0  0
 25 22  1  0  0  0  0
 22 23  2  0  0  0  0
  5 17  1  0  0  0  0
 10  7  2  0  0  0  0
M  END
>  <Mol_ID> (2,372)
2372

>  <Formula> (2,372)
C14H16ClN5O3S2

>  <MolWeight> (2,372)
401.89154

>  <PCAT_CMPD_ID> (2,372)
WAY-344905

>  <CNC_ID> (2,372)
359320216

>  <transfer_container_id> (2,372)
PTN000000065

>  <COMPOUND_NUMBER> (2,372)
WAY-344905

>  <BAR_CODE_NO> (2,372)
2555137

>  <LOCATION_CODE> (2,372)
PTNCS

>  <AMOUNT_CURRENT> (2,372)
32.4

$$$$
WAY-311032
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
   -1.5000    0.4897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 14  1  0  0  0  0
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 13 16  1  0  0  0  0
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 25 28  1  0  0  0  0
  5  8  1  0  0  0  0
 15 17  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,373)
2373

>  <Formula> (2,373)
C20H17BrN2O3S2

>  <MolWeight> (2,373)
477.39458

>  <PCAT_CMPD_ID> (2,373)
WAY-311032

>  <CNC_ID> (2,373)
359314774

>  <transfer_container_id> (2,373)
PTN000000065

>  <COMPOUND_NUMBER> (2,373)
WAY-311032

>  <BAR_CODE_NO> (2,373)
3915367

>  <LOCATION_CODE> (2,373)
PTNCS

>  <AMOUNT_CURRENT> (2,373)
33.3

$$$$
WAY-313012
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
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 10 11  1  0  0  0  0
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 17 19  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,374)
2374

>  <Formula> (2,374)
C15H13NO2S

>  <MolWeight> (2,374)
271.33422

>  <PCAT_CMPD_ID> (2,374)
WAY-313012

>  <CNC_ID> (2,374)
359328049

>  <transfer_container_id> (2,374)
PTN000000067

>  <COMPOUND_NUMBER> (2,374)
WAY-313012

>  <BAR_CODE_NO> (2,374)
3917781

>  <LOCATION_CODE> (2,374)
PTNCS

>  <AMOUNT_CURRENT> (2,374)
33

$$$$
GI-570473
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 16 18  2  0  0  0  0
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  9 13  1  0  0  0  0
 12 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,375)
2375

>  <Formula> (2,375)
C12H12N2O2S2

>  <MolWeight> (2,375)
280.36588

>  <PCAT_CMPD_ID> (2,375)
GI-570473

>  <CNC_ID> (2,375)
359313670

>  <transfer_container_id> (2,375)
PTN000000065

>  <COMPOUND_NUMBER> (2,375)
GI-570473

>  <BAR_CODE_NO> (2,375)
3915251

>  <LOCATION_CODE> (2,375)
PTNCS

>  <AMOUNT_CURRENT> (2,375)
33.9

$$$$
WAY-311435
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,376)
2376

>  <Formula> (2,376)
C15H21N5O3S

>  <MolWeight> (2,376)
351.42394

>  <PCAT_CMPD_ID> (2,376)
WAY-311435

>  <CNC_ID> (2,376)
359315176

>  <transfer_container_id> (2,376)
PTN000000065

>  <COMPOUND_NUMBER> (2,376)
WAY-311435

>  <BAR_CODE_NO> (2,376)
3915821

>  <LOCATION_CODE> (2,376)
PTNCS

>  <AMOUNT_CURRENT> (2,376)
33.9

$$$$
WAY-310729
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 22 24  1  0  0  0  0
  5  7  2  0  0  0  0
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 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,377)
2377

>  <Formula> (2,377)
C16H23N5O2S

>  <MolWeight> (2,377)
349.45112

>  <PCAT_CMPD_ID> (2,377)
WAY-310729

>  <CNC_ID> (2,377)
359314470

>  <transfer_container_id> (2,377)
PTN000000065

>  <COMPOUND_NUMBER> (2,377)
WAY-310729

>  <BAR_CODE_NO> (2,377)
3914990

>  <LOCATION_CODE> (2,377)
PTNCS

>  <AMOUNT_CURRENT> (2,377)
33.6

$$$$
WAY-623485
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
 12  5  2  0  0  0  0
 13  6  2  0  0  0  0
 14  8  2  0  0  0  0
 15 11  1  0  0  0  0
 16 14  1  0  0  0  0
 17  7  2  0  0  0  0
 18  9  1  0  0  0  0
 19 10  1  0  0  0  0
 20  3  1  0  0  0  0
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 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,378)
2378

>  <Formula> (2,378)
C13H16N2O5

>  <MolWeight> (2,378)
280.27654

>  <PCAT_CMPD_ID> (2,378)
WAY-623485

>  <CNC_ID> (2,378)
359322105

>  <transfer_container_id> (2,378)
PTN000000065

>  <COMPOUND_NUMBER> (2,378)
WAY-623485

>  <BAR_CODE_NO> (2,378)
90457654

>  <LOCATION_CODE> (2,378)
PTNCS

>  <AMOUNT_CURRENT> (2,378)
32.8

$$$$
WAY-331816
csChFnd80/10111816222D

 24 25  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 15  8  1  0  0  0  0
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 19  9  1  0  0  0  0
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 23 19  1  0  0  0  0
 24 22  1  0  0  0  0
 16 17  2  0  0  0  0
  7  2  2  0  0  0  0
M  END
>  <Mol_ID> (2,379)
2379

>  <Formula> (2,379)
C17H21NO5S

>  <MolWeight> (2,379)
351.41734

>  <PCAT_CMPD_ID> (2,379)
WAY-331816

>  <CNC_ID> (2,379)
359330354

>  <transfer_container_id> (2,379)
PTN000000067

>  <COMPOUND_NUMBER> (2,379)
WAY-331816

>  <BAR_CODE_NO> (2,379)
306817

>  <LOCATION_CODE> (2,379)
PTNCS

>  <AMOUNT_CURRENT> (2,379)
32.5

$$$$
WAY-331819
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 12  1  2  0  0  0  0
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 17 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,380)
2380

>  <Formula> (2,380)
C20H18FNO5S

>  <MolWeight> (2,380)
403.4240232

>  <PCAT_CMPD_ID> (2,380)
WAY-331819

>  <CNC_ID> (2,380)
359330357

>  <transfer_container_id> (2,380)
PTN000000067

>  <COMPOUND_NUMBER> (2,380)
WAY-331819

>  <BAR_CODE_NO> (2,380)
306820

>  <LOCATION_CODE> (2,380)
PTNCS

>  <AMOUNT_CURRENT> (2,380)
32.5

$$$$
WAY-330434
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 12  5  1  0  0  0  0
 13  1  2  0  0  0  0
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 15  3  2  0  0  0  0
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 18  8  2  0  0  0  0
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  4 11  1  0  0  0  0
 26 21  2  0  0  0  0
  6  2  2  0  0  0  0
 30 32  1  0  0  0  0
M  END
>  <Mol_ID> (2,381)
2381

>  <Formula> (2,381)
C23H25N3O5S

>  <MolWeight> (2,381)
455.5267

>  <PCAT_CMPD_ID> (2,381)
WAY-330434

>  <CNC_ID> (2,381)
359317789

>  <transfer_container_id> (2,381)
PTN000000065

>  <COMPOUND_NUMBER> (2,381)
WAY-330434

>  <BAR_CODE_NO> (2,381)
305435

>  <LOCATION_CODE> (2,381)
PTNCS

>  <AMOUNT_CURRENT> (2,381)
32.5

$$$$
WAY-330484
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   -4.3333    8.0875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 12 11  2  0  0  0  0
 13 21  2  0  0  0  0
 14  5  1  0  0  0  0
 15  1  2  0  0  0  0
 16  1  2  0  0  0  0
 17  3  2  0  0  0  0
 18  5  2  0  0  0  0
 19 12  1  0  0  0  0
 20  9  2  0  0  0  0
 21 20  1  0  0  0  0
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 23 14  1  0  0  0  0
 24 11  1  0  0  0  0
 25 12  1  0  0  0  0
 26 24  2  0  0  0  0
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 29 23  1  0  0  0  0
 30 28  1  0  0  0  0
 31 29  1  0  0  0  0
  4 13  1  0  0  0  0
 27 19  2  0  0  0  0
  6  2  2  0  0  0  0
 31 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,382)
2382

>  <Formula> (2,382)
C22H22ClN3O4S

>  <MolWeight> (2,382)
459.94578

>  <PCAT_CMPD_ID> (2,382)
WAY-330484

>  <CNC_ID> (2,382)
359317839

>  <transfer_container_id> (2,382)
PTN000000065

>  <COMPOUND_NUMBER> (2,382)
WAY-330484

>  <BAR_CODE_NO> (2,382)
305485

>  <LOCATION_CODE> (2,382)
PTNCS

>  <AMOUNT_CURRENT> (2,382)
32.5

$$$$
WAY-330834
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
    9.5875   -7.9000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.2500   -7.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  4  1  1  0  0  0  0
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  6  2  1  0  0  0  0
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  9  4  2  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 14  2  0  0  0  0
 13 18  2  0  0  0  0
 14  4  1  0  0  0  0
 15  6  2  0  0  0  0
 16  8  2  0  0  0  0
 17  5  1  0  0  0  0
 18 23  1  0  0  0  0
 19 22  2  0  0  0  0
 20  2  1  0  0  0  0
 21  8  1  0  0  0  0
 22 17  1  0  0  0  0
 23 17  2  0  0  0  0
 24  7  1  0  0  0  0
 25  6  1  0  0  0  0
 26 24  1  0  0  0  0
 27 21  1  0  0  0  0
 28 27  1  0  0  0  0
  7  3  2  0  0  0  0
 19 13  1  0  0  0  0
 26 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,383)
2383

>  <Formula> (2,383)
C20H22N2O5S

>  <MolWeight> (2,383)
402.46408

>  <PCAT_CMPD_ID> (2,383)
WAY-330834

>  <CNC_ID> (2,383)
359318189

>  <transfer_container_id> (2,383)
PTN000000065

>  <COMPOUND_NUMBER> (2,383)
WAY-330834

>  <BAR_CODE_NO> (2,383)
305835

>  <LOCATION_CODE> (2,383)
PTNCS

>  <AMOUNT_CURRENT> (2,383)
32.5

$$$$
WAY-332656
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
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  7  1  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12  9  1  0  0  0  0
 13  7  2  0  0  0  0
 14 10  1  0  0  0  0
 15  5  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  2  0  0  0  0
 18 14  2  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
 21 10  2  0  0  0  0
 22 17  1  0  0  0  0
 23 21  1  0  0  0  0
 24 23  2  0  0  0  0
 25 22  1  0  0  0  0
  5  4  1  0  0  0  0
  8 11  2  0  0  0  0
 24 18  1  0  0  0  0
 19 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,384)
2384

>  <Formula> (2,384)
C18H13ClN4O2

>  <MolWeight> (2,384)
352.77442

>  <PCAT_CMPD_ID> (2,384)
WAY-332656

>  <CNC_ID> (2,384)
359331192

>  <transfer_container_id> (2,384)
PTN000000067

>  <COMPOUND_NUMBER> (2,384)
WAY-332656

>  <BAR_CODE_NO> (2,384)
307657

>  <LOCATION_CODE> (2,384)
PTNCS

>  <AMOUNT_CURRENT> (2,384)
32.5

$$$$
WAY-331189
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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 10  5  2  0  0  0  0
 11  9  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14  3  2  0  0  0  0
 15  7  1  0  0  0  0
 16 17  1  0  0  0  0
 17 15  2  0  0  0  0
 18  4  1  0  0  0  0
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 20  6  1  0  0  0  0
 21 16  1  0  0  0  0
 22 20  1  0  0  0  0
 23 12  1  0  0  0  0
 24 21  1  0  0  0  0
  6  4  1  0  0  0  0
 11 16  2  0  0  0  0
 22 18  1  0  0  0  0
 13 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,385)
2385

>  <Formula> (2,385)
C18H19ClN2O3

>  <MolWeight> (2,385)
346.80806

>  <PCAT_CMPD_ID> (2,385)
WAY-331189

>  <CNC_ID> (2,385)
359318544

>  <transfer_container_id> (2,385)
PTN000000065

>  <COMPOUND_NUMBER> (2,385)
WAY-331189

>  <BAR_CODE_NO> (2,385)
306190

>  <LOCATION_CODE> (2,385)
PTNCS

>  <AMOUNT_CURRENT> (2,385)
32.5

$$$$
WAY-330661
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
   12.7500   -1.1750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.0125   -1.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.8625   -0.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6375   -2.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4875   -1.1750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   11.4750   -3.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  2  0  0  0  0
  4  2  2  0  0  0  0
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  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8 14  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
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 14 20  1  0  0  0  0
 15  9  1  0  0  0  0
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 17  8  2  0  0  0  0
 18  7  1  0  0  0  0
 19 23  1  0  0  0  0
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 22 15  2  0  0  0  0
 23 18  2  0  0  0  0
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 25 13  1  0  0  0  0
 26 16  1  0  0  0  0
 27  4  1  0  0  0  0
 28  5  1  0  0  0  0
 29 25  1  0  0  0  0
 30 26  1  0  0  0  0
  3  6  1  0  0  0  0
 19 14  2  0  0  0  0
 16 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,386)
2386

>  <Formula> (2,386)
C20H21N3O6S

>  <MolWeight> (2,386)
431.46224

>  <PCAT_CMPD_ID> (2,386)
WAY-330661

>  <CNC_ID> (2,386)
359318016

>  <transfer_container_id> (2,386)
PTN000000065

>  <COMPOUND_NUMBER> (2,386)
WAY-330661

>  <BAR_CODE_NO> (2,386)
305662

>  <LOCATION_CODE> (2,386)
PTNCS

>  <AMOUNT_CURRENT> (2,386)
32.5

$$$$
WAY-331598
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
   12.8125   -9.6125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.5875  -10.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  8  2  1  0  0  0  0
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 10  7  1  0  0  0  0
 11 18  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  3  1  0  0  0  0
 15 10  1  0  0  0  0
 16 10  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19  7  2  0  0  0  0
 20 11  1  0  0  0  0
 21 14  1  0  0  0  0
 22 14  2  0  0  0  0
 23 25  2  0  0  0  0
 24 21  2  0  0  0  0
 25 22  1  0  0  0  0
 26  6  1  0  0  0  0
 27  8  1  0  0  0  0
 28 23  1  0  0  0  0
 29 20  2  0  0  0  0
 30 20  1  0  0  0  0
 31 28  1  0  0  0  0
 32 29  1  0  0  0  0
 33 30  2  0  0  0  0
 34 33  1  0  0  0  0
  5  9  1  0  0  0  0
 24 23  1  0  0  0  0
 17 11  1  0  0  0  0
 34 32  2  0  0  0  0
M  END
>  <Mol_ID> (2,387)
2387

>  <Formula> (2,387)
C24H28N4O5S

>  <MolWeight> (2,387)
484.56792

>  <PCAT_CMPD_ID> (2,387)
WAY-331598

>  <CNC_ID> (2,387)
359330136

>  <transfer_container_id> (2,387)
PTN000000067

>  <COMPOUND_NUMBER> (2,387)
WAY-331598

>  <BAR_CODE_NO> (2,387)
306599

>  <LOCATION_CODE> (2,387)
PTNCS

>  <AMOUNT_CURRENT> (2,387)
32.5

$$$$
WAY-643327
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  2  0  0  0  0
  7  4  1  0  0  0  0
  8 23  1  0  0  0  0
  9  3  1  0  0  0  0
 10  8  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  2  1  0  0  0  0
 14  2  1  0  0  0  0
 15 10  2  0  0  0  0
 16  3  2  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
 19  9  1  0  0  0  0
 20  7  2  0  0  0  0
 21 16  1  0  0  0  0
 22  7  1  0  0  0  0
 23 24  1  0  0  0  0
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 25 10  1  0  0  0  0
 26 15  1  0  0  0  0
 27 25  2  0  0  0  0
 28 27  1  0  0  0  0
 19 21  2  0  0  0  0
  4 18  1  0  0  0  0
 15  5  1  0  0  0  0
 28 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,388)
2388

>  <Formula> (2,388)
C20H23N3O3S2

>  <MolWeight> (2,388)
417.54492

>  <PCAT_CMPD_ID> (2,388)
WAY-643327

>  <CNC_ID> (2,388)
359325065

>  <transfer_container_id> (2,388)
PTN000000065

>  <COMPOUND_NUMBER> (2,388)
WAY-643327

>  <BAR_CODE_NO> (2,388)
90477898

>  <LOCATION_CODE> (2,388)
PTNCS

>  <AMOUNT_CURRENT> (2,388)
20.89

$$$$
WAY-278420
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.5277   -0.2033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  3  8  2  0  0  0  0
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  4 10  2  0  0  0  0
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  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
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 15 19  1  0  0  0  0
 17 20  2  0  0  0  0
 18 21  1  0  0  0  0
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 20 23  1  0  0  0  0
  5 10  1  0  0  0  0
 16 19  2  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,389)
2389

>  <Formula> (2,389)
C17H16N2O3S

>  <MolWeight> (2,389)
328.38554

>  <PCAT_CMPD_ID> (2,389)
WAY-278420

>  <CNC_ID> (2,389)
359327140

>  <transfer_container_id> (2,389)
PTN000000067

>  <COMPOUND_NUMBER> (2,389)
WAY-278420

>  <BAR_CODE_NO> (2,389)
389075

>  <LOCATION_CODE> (2,389)
PTNCS

>  <AMOUNT_CURRENT> (2,389)
32.5

$$$$
WAY-624605
csChFnd80/10111816222D

 31 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,390)
2390

>  <Formula> (2,390)
C24H20N2O5

>  <MolWeight> (2,390)
416.426

>  <PCAT_CMPD_ID> (2,390)
WAY-624605

>  <CNC_ID> (2,390)
359323026

>  <transfer_container_id> (2,390)
PTN000000065

>  <COMPOUND_NUMBER> (2,390)
WAY-624605

>  <BAR_CODE_NO> (2,390)
90458781

>  <LOCATION_CODE> (2,390)
PTNCS

>  <AMOUNT_CURRENT> (2,390)
32.5

$$$$
WAY-624639
csChFnd80/10111816222D

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 15  2  2  0  0  0  0
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M  END
>  <Mol_ID> (2,391)
2391

>  <Formula> (2,391)
C15H15N3O4S

>  <MolWeight> (2,391)
333.3623

>  <PCAT_CMPD_ID> (2,391)
WAY-624639

>  <CNC_ID> (2,391)
359323060

>  <transfer_container_id> (2,391)
PTN000000065

>  <COMPOUND_NUMBER> (2,391)
WAY-624639

>  <BAR_CODE_NO> (2,391)
90458815

>  <LOCATION_CODE> (2,391)
PTNCS

>  <AMOUNT_CURRENT> (2,391)
32.5

$$$$
WAY-616663
csChFnd80/10111816222D

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  7  5  2  0  0  0  0
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M  END
>  <Mol_ID> (2,392)
2392

>  <Formula> (2,392)
C18H13N3O2S

>  <MolWeight> (2,392)
335.37972

>  <PCAT_CMPD_ID> (2,392)
WAY-616663

>  <CNC_ID> (2,392)
359321749

>  <transfer_container_id> (2,392)
PTN000000065

>  <COMPOUND_NUMBER> (2,392)
WAY-616663

>  <BAR_CODE_NO> (2,392)
90450655

>  <LOCATION_CODE> (2,392)
PTNCS

>  <AMOUNT_CURRENT> (2,392)
32.4

$$$$
WAY-332733
csChFnd80/10111816222D

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  4 14  1  0  0  0  0
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 16  3  1  0  0  0  0
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M  END
>  <Mol_ID> (2,393)
2393

>  <Formula> (2,393)
C22H24FN3O2

>  <MolWeight> (2,393)
381.4432632

>  <PCAT_CMPD_ID> (2,393)
WAY-332733

>  <CNC_ID> (2,393)
359331269

>  <transfer_container_id> (2,393)
PTN000000067

>  <COMPOUND_NUMBER> (2,393)
WAY-332733

>  <BAR_CODE_NO> (2,393)
307734

>  <LOCATION_CODE> (2,393)
PTNCS

>  <AMOUNT_CURRENT> (2,393)
32.5

$$$$
WAY-331030
csChFnd80/10111816222D

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 19  9  2  0  0  0  0
 20  4  1  0  0  0  0
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 22 21  1  0  0  0  0
 23  9  1  0  0  0  0
 24 20  1  0  0  0  0
 25 20  1  0  0  0  0
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 30 29  1  0  0  0  0
  5  8  2  0  0  0  0
  2 10  1  0  0  0  0
 28 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,394)
2394

>  <Formula> (2,394)
C22H27N3O4S

>  <MolWeight> (2,394)
429.53248

>  <PCAT_CMPD_ID> (2,394)
WAY-331030

>  <CNC_ID> (2,394)
359318385

>  <transfer_container_id> (2,394)
PTN000000065

>  <COMPOUND_NUMBER> (2,394)
WAY-331030

>  <BAR_CODE_NO> (2,394)
306031

>  <LOCATION_CODE> (2,394)
PTNCS

>  <AMOUNT_CURRENT> (2,394)
32.5

$$$$
WAY-331069
csChFnd80/10111816222D

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 10 16  2  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  1  0  0  0  0
 14  9  1  0  0  0  0
 15  5  1  0  0  0  0
 16  4  1  0  0  0  0
 17 21  1  0  0  0  0
 18  6  2  0  0  0  0
 19 14  1  0  0  0  0
 20  9  2  0  0  0  0
 21 13  1  0  0  0  0
 22 19  2  0  0  0  0
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 24  6  1  0  0  0  0
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 28 23  1  0  0  0  0
  3  5  2  0  0  0  0
  2  7  1  0  0  0  0
 23 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,395)
2395

>  <Formula> (2,395)
C20H23N3O4S

>  <MolWeight> (2,395)
401.47932

>  <PCAT_CMPD_ID> (2,395)
WAY-331069

>  <CNC_ID> (2,395)
359318424

>  <transfer_container_id> (2,395)
PTN000000065

>  <COMPOUND_NUMBER> (2,395)
WAY-331069

>  <BAR_CODE_NO> (2,395)
306070

>  <LOCATION_CODE> (2,395)
PTNCS

>  <AMOUNT_CURRENT> (2,395)
32.5

$$$$
WAY-615880
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  4  1  0  0  0  0
 12  8  1  0  0  0  0
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 14 19  2  0  0  0  0
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 17 10  2  0  0  0  0
 18  6  1  0  0  0  0
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 20 22  2  0  0  0  0
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 22 17  1  0  0  0  0
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 24 20  1  0  0  0  0
  2  5  1  0  0  0  0
 20 23  1  0  0  0  0
  7  8  2  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,396)
2396

>  <Formula> (2,396)
C17H14ClN3O2S

>  <MolWeight> (2,396)
359.82996

>  <PCAT_CMPD_ID> (2,396)
WAY-615880

>  <CNC_ID> (2,396)
359320965

>  <transfer_container_id> (2,396)
PTN000000065

>  <COMPOUND_NUMBER> (2,396)
WAY-615880

>  <BAR_CODE_NO> (2,396)
90449852

>  <LOCATION_CODE> (2,396)
PTNCS

>  <AMOUNT_CURRENT> (2,396)
32.2

$$$$
WAY-623893
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 12  9  2  0  0  0  0
 31 32  1  0  0  0  0
 19 11  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,397)
2397

>  <Formula> (2,397)
C24H24N2O6

>  <MolWeight> (2,397)
436.45716

>  <PCAT_CMPD_ID> (2,397)
WAY-623893

>  <CNC_ID> (2,397)
359322512

>  <transfer_container_id> (2,397)
PTN000000065

>  <COMPOUND_NUMBER> (2,397)
WAY-623893

>  <BAR_CODE_NO> (2,397)
90458065

>  <LOCATION_CODE> (2,397)
PTNCS

>  <AMOUNT_CURRENT> (2,397)
32.8

$$$$
WAY-331858
csChFnd80/10111816222D

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 21  9  1  0  0  0  0
 29 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,398)
2398

>  <Formula> (2,398)
C23H23ClN2O5S

>  <MolWeight> (2,398)
474.95712

>  <PCAT_CMPD_ID> (2,398)
WAY-331858

>  <CNC_ID> (2,398)
359330396

>  <transfer_container_id> (2,398)
PTN000000067

>  <COMPOUND_NUMBER> (2,398)
WAY-331858

>  <BAR_CODE_NO> (2,398)
306859

>  <LOCATION_CODE> (2,398)
PTNCS

>  <AMOUNT_CURRENT> (2,398)
32.5

$$$$
WAY-331862
csChFnd80/10111816222D

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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,399)
2399

>  <Formula> (2,399)
C25H28N2O5S

>  <MolWeight> (2,399)
468.56522

>  <PCAT_CMPD_ID> (2,399)
WAY-331862

>  <CNC_ID> (2,399)
359330400

>  <transfer_container_id> (2,399)
PTN000000067

>  <COMPOUND_NUMBER> (2,399)
WAY-331862

>  <BAR_CODE_NO> (2,399)
306863

>  <LOCATION_CODE> (2,399)
PTNCS

>  <AMOUNT_CURRENT> (2,399)
32.5

$$$$
WAY-331856
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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 20  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,400)
2400

>  <Formula> (2,400)
C24H26N2O6S

>  <MolWeight> (2,400)
470.53804

>  <PCAT_CMPD_ID> (2,400)
WAY-331856

>  <CNC_ID> (2,400)
359330394

>  <transfer_container_id> (2,400)
PTN000000067

>  <COMPOUND_NUMBER> (2,400)
WAY-331856

>  <BAR_CODE_NO> (2,400)
306857

>  <LOCATION_CODE> (2,400)
PTNCS

>  <AMOUNT_CURRENT> (2,400)
32.5

$$$$
WAY-624059
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,401)
2401

>  <Formula> (2,401)
C23H22BrN3O4

>  <MolWeight> (2,401)
484.34248

>  <PCAT_CMPD_ID> (2,401)
WAY-624059

>  <CNC_ID> (2,401)
359322679

>  <transfer_container_id> (2,401)
PTN000000065

>  <COMPOUND_NUMBER> (2,401)
WAY-624059

>  <BAR_CODE_NO> (2,401)
90458233

>  <LOCATION_CODE> (2,401)
PTNCS

>  <AMOUNT_CURRENT> (2,401)
32.6

$$$$
WAY-641958
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  6  1  0  0  0  0
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  6  9  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12  2  1  0  0  0  0
 13 11  2  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16  3  2  0  0  0  0
 17  9  2  0  0  0  0
 18 12  2  0  0  0  0
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 21  2  1  0  0  0  0
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 23  8  1  0  0  0  0
 24 10  1  0  0  0  0
 25 12  1  0  0  0  0
 26 21  1  0  0  0  0
 27 26  1  0  0  0  0
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 29 22  1  0  0  0  0
 30 24  1  0  0  0  0
 31 23  1  0  0  0  0
 32 25  2  0  0  0  0
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 27 18  1  0  0  0  0
 33 28  2  0  0  0  0
 10  8  2  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (2,402)
2402

>  <Formula> (2,402)
C24H25N3O4S2

>  <MolWeight> (2,402)
483.603

>  <PCAT_CMPD_ID> (2,402)
WAY-641958

>  <CNC_ID> (2,402)
359323696

>  <transfer_container_id> (2,402)
PTN000000065

>  <COMPOUND_NUMBER> (2,402)
WAY-641958

>  <BAR_CODE_NO> (2,402)
90476511

>  <LOCATION_CODE> (2,402)
PTNCS

>  <AMOUNT_CURRENT> (2,402)
32.6

$$$$
WAY-333200
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    3.3613    2.3466    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  7  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  2  0  0  0  0
  8  5  1  0  0  0  0
  9  8  1  0  0  0  0
 10  2  2  0  0  0  0
 11  8  2  0  0  0  0
 12  9  1  0  0  0  0
 13 11  1  0  0  0  0
 14  1  1  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  2  0  0  0  0
 19 18  1  0  0  0  0
  3  5  1  0  0  0  0
 16 19  2  0  0  0  0
 13 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,403)
2403

>  <Formula> (2,403)
C15H15NO2S

>  <MolWeight> (2,403)
273.3501

>  <PCAT_CMPD_ID> (2,403)
WAY-333200

>  <CNC_ID> (2,403)
359331735

>  <transfer_container_id> (2,403)
PTN000000067

>  <COMPOUND_NUMBER> (2,403)
WAY-333200

>  <BAR_CODE_NO> (2,403)
308201

>  <LOCATION_CODE> (2,403)
PTNCS

>  <AMOUNT_CURRENT> (2,403)
32.5

$$$$
WAY-643415
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    0.0417    0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7375    0.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4 12  1  0  0  0  0
  5  4  1  0  0  0  0
  6  4  2  0  0  0  0
  7  9  2  0  0  0  0
  8  6  1  0  0  0  0
  9  1  1  0  0  0  0
 10  5  1  0  0  0  0
 11  1  1  0  0  0  0
 12 14  1  0  0  0  0
 13  3  1  0  0  0  0
 14 11  1  0  0  0  0
 15 11  2  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18  2  1  0  0  0  0
 19  5  1  0  0  0  0
 20  7  1  0  0  0  0
 21 17  1  0  0  0  0
 22 16  2  0  0  0  0
 23 21  2  0  0  0  0
 24 23  1  0  0  0  0
  3  7  1  0  0  0  0
 10  8  2  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,404)
2404

>  <Formula> (2,404)
C17H19N5OS

>  <MolWeight> (2,404)
341.43066

>  <PCAT_CMPD_ID> (2,404)
WAY-643415

>  <CNC_ID> (2,404)
359325153

>  <transfer_container_id> (2,404)
PTN000000065

>  <COMPOUND_NUMBER> (2,404)
WAY-643415

>  <BAR_CODE_NO> (2,404)
90477987

>  <LOCATION_CODE> (2,404)
PTNCS

>  <AMOUNT_CURRENT> (2,404)
32.8

$$$$
WAY-624671
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.6875    1.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  2  0  0  0  0
 11 13  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  1  0  0  0  0
 14 10  1  0  0  0  0
 15  7  2  0  0  0  0
 16  5  1  0  0  0  0
 17  9  1  0  0  0  0
 18 14  1  0  0  0  0
 19  8  1  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
  8  4  1  0  0  0  0
 21 19  2  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,405)
2405

>  <Formula> (2,405)
C15H13NO5

>  <MolWeight> (2,405)
287.26742

>  <PCAT_CMPD_ID> (2,405)
WAY-624671

>  <CNC_ID> (2,405)
359323092

>  <transfer_container_id> (2,405)
PTN000000065

>  <COMPOUND_NUMBER> (2,405)
WAY-624671

>  <BAR_CODE_NO> (2,405)
90458847

>  <LOCATION_CODE> (2,405)
PTNCS

>  <AMOUNT_CURRENT> (2,405)
33

$$$$
WAY-616537
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 16  1  0  0  0  0
 11  4  1  0  0  0  0
 12  2  1  0  0  0  0
 13  5  2  0  0  0  0
 14 17  1  0  0  0  0
 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17  8  1  0  0  0  0
 18 11  2  0  0  0  0
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 24 21  1  0  0  0  0
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 26 24  2  0  0  0  0
  3  2  1  0  0  0  0
 10  7  2  0  0  0  0
 12 19  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,406)
2406

>  <Formula> (2,406)
C23H23NO2

>  <MolWeight> (2,406)
345.43422

>  <PCAT_CMPD_ID> (2,406)
WAY-616537

>  <CNC_ID> (2,406)
359321623

>  <transfer_container_id> (2,406)
PTN000000065

>  <COMPOUND_NUMBER> (2,406)
WAY-616537

>  <BAR_CODE_NO> (2,406)
90450529

>  <LOCATION_CODE> (2,406)
PTNCS

>  <AMOUNT_CURRENT> (2,406)
32.4

$$$$
WAY-333184
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  1  1  0  0  0  0
  8  5  1  0  0  0  0
  9  2  2  0  0  0  0
 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12  6  1  0  0  0  0
 13  8  1  0  0  0  0
 14 10  1  0  0  0  0
 15 10  2  0  0  0  0
 16 11  2  0  0  0  0
 17 16  1  0  0  0  0
 18 14  2  0  0  0  0
 19 15  1  0  0  0  0
 20 19  2  0  0  0  0
  4  8  1  0  0  0  0
 12 17  2  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,407)
2407

>  <Formula> (2,407)
C17H17NOS

>  <MolWeight> (2,407)
283.38798

>  <PCAT_CMPD_ID> (2,407)
WAY-333184

>  <CNC_ID> (2,407)
359331719

>  <transfer_container_id> (2,407)
PTN000000067

>  <COMPOUND_NUMBER> (2,407)
WAY-333184

>  <BAR_CODE_NO> (2,407)
308185

>  <LOCATION_CODE> (2,407)
PTNCS

>  <AMOUNT_CURRENT> (2,407)
32.5

$$$$
WAY-641698
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    0.0917   -0.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6  3  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  2  0  0  0  0
 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
 12 13  1  0  0  0  0
 13  6  2  0  0  0  0
 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16 12  2  0  0  0  0
 17 11  1  0  0  0  0
 18 10  1  0  0  0  0
 19 10  1  0  0  0  0
 20 15  2  0  0  0  0
 21 14  1  0  0  0  0
 22 19  1  0  0  0  0
 23 18  1  0  0  0  0
 24 20  1  0  0  0  0
 16  9  1  0  0  0  0
 24 21  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,408)
2408

>  <Formula> (2,408)
C20H24N2O2

>  <MolWeight> (2,408)
324.41676

>  <PCAT_CMPD_ID> (2,408)
WAY-641698

>  <CNC_ID> (2,408)
359323436

>  <transfer_container_id> (2,408)
PTN000000065

>  <COMPOUND_NUMBER> (2,408)
WAY-641698

>  <BAR_CODE_NO> (2,408)
90476250

>  <LOCATION_CODE> (2,408)
PTNCS

>  <AMOUNT_CURRENT> (2,408)
32.3

$$$$
WAY-333194
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  4  2  1  0  0  0  0
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  7  5  2  0  0  0  0
  8  6  1  0  0  0  0
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 10  8  2  0  0  0  0
 11 10  1  0  0  0  0
 12  2  2  0  0  0  0
 13 16  1  0  0  0  0
 14  8  1  0  0  0  0
 15  9  1  0  0  0  0
 16 14  2  0  0  0  0
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 20 18  1  0  0  0  0
 21 13  1  0  0  0  0
 22  5  1  0  0  0  0
 23  7  1  0  0  0  0
 24 25  1  0  0  0  0
 25 15  2  0  0  0  0
 26 24  2  0  0  0  0
 27 19  1  0  0  0  0
 28 21  1  0  0  0  0
 29 22  2  0  0  0  0
 30 29  1  0  0  0  0
  3  6  1  0  0  0  0
 30 23  2  0  0  0  0
 26 18  1  0  0  0  0
 11 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,409)
2409

>  <Formula> (2,409)
C24H22FNO3S

>  <MolWeight> (2,409)
423.4997832

>  <PCAT_CMPD_ID> (2,409)
WAY-333194

>  <CNC_ID> (2,409)
359331729

>  <transfer_container_id> (2,409)
PTN000000067

>  <COMPOUND_NUMBER> (2,409)
WAY-333194

>  <BAR_CODE_NO> (2,409)
308195

>  <LOCATION_CODE> (2,409)
PTNCS

>  <AMOUNT_CURRENT> (2,409)
32.5

$$$$
WAY-331176
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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   13.6625   -2.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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  4  1  1  0  0  0  0
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  6  2  1  0  0  0  0
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  8  9  1  0  0  0  0
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 10  4  1  0  0  0  0
 11 17  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  8  1  0  0  0  0
 15  1  1  0  0  0  0
 16  5  1  0  0  0  0
 17  4  2  0  0  0  0
 18 22  1  0  0  0  0
 19  6  2  0  0  0  0
 20  9  2  0  0  0  0
 21 14  2  0  0  0  0
 22 15  1  0  0  0  0
 23  6  1  0  0  0  0
 24 14  1  0  0  0  0
 25 21  1  0  0  0  0
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 27 23  1  0  0  0  0
 28 24  2  0  0  0  0
 29 28  1  0  0  0  0
  5  3  1  0  0  0  0
  2  7  1  0  0  0  0
 29 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,410)
2410

>  <Formula> (2,410)
C21H25N3O4S

>  <MolWeight> (2,410)
415.5059

>  <PCAT_CMPD_ID> (2,410)
WAY-331176

>  <CNC_ID> (2,410)
359318531

>  <transfer_container_id> (2,410)
PTN000000065

>  <COMPOUND_NUMBER> (2,410)
WAY-331176

>  <BAR_CODE_NO> (2,410)
306177

>  <LOCATION_CODE> (2,410)
PTNCS

>  <AMOUNT_CURRENT> (2,410)
32.5

$$$$
WAY-330119
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  7  1  0  0  0  0
 12  4  1  0  0  0  0
 13  2  2  0  0  0  0
 14  2  2  0  0  0  0
 15  2  1  0  0  0  0
 16  3  2  0  0  0  0
 17  8  1  0  0  0  0
 18 12  2  0  0  0  0
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 26 21  1  0  0  0  0
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  7 17  1  0  0  0  0
 11  6  2  0  0  0  0
 10  9  1  0  0  0  0
 25 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,411)
2411

>  <Formula> (2,411)
C21H24N2O3S

>  <MolWeight> (2,411)
384.49186

>  <PCAT_CMPD_ID> (2,411)
WAY-330119

>  <CNC_ID> (2,411)
359317483

>  <transfer_container_id> (2,411)
PTN000000065

>  <COMPOUND_NUMBER> (2,411)
WAY-330119

>  <BAR_CODE_NO> (2,411)
305120

>  <LOCATION_CODE> (2,411)
PTNCS

>  <AMOUNT_CURRENT> (2,411)
32.5

$$$$
WAY-330163
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
    8.1250   -5.8125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7875   -4.4458    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    8.8375   -4.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6875   -5.2000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.7500   -6.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1375   -4.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1250   -4.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4875   -4.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7375   -4.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3875   -5.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.0375   -5.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -6.7125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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   14.6875   -5.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  7  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  1  1  0  0  0  0
  7 17  1  0  0  0  0
  8  5  1  0  0  0  0
  9  4  1  0  0  0  0
 10 13  1  0  0  0  0
 11  3  1  0  0  0  0
 12  2  1  0  0  0  0
 13 12  1  0  0  0  0
 14  2  2  0  0  0  0
 15  2  2  0  0  0  0
 16 10  1  0  0  0  0
 17 11  2  0  0  0  0
 18  6  2  0  0  0  0
 19 10  2  0  0  0  0
 20 16  1  0  0  0  0
 21 25  2  0  0  0  0
 22 20  1  0  0  0  0
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 25 27  1  0  0  0  0
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 27 22  2  0  0  0  0
 28  5  1  0  0  0  0
 29  6  1  0  0  0  0
  4  8  1  0  0  0  0
  9  7  2  0  0  0  0
 24 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,412)
2412

>  <Formula> (2,412)
C21H23FN2O4S

>  <MolWeight> (2,412)
418.4817232

>  <PCAT_CMPD_ID> (2,412)
WAY-330163

>  <CNC_ID> (2,412)
359317527

>  <transfer_container_id> (2,412)
PTN000000065

>  <COMPOUND_NUMBER> (2,412)
WAY-330163

>  <BAR_CODE_NO> (2,412)
305164

>  <LOCATION_CODE> (2,412)
PTNCS

>  <AMOUNT_CURRENT> (2,412)
32.5

$$$$
WAY-330807
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  9  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  8  1  0  0  0  0
  7 11  1  0  0  0  0
  8  5  2  0  0  0  0
  9 15  2  0  0  0  0
 10  1  1  0  0  0  0
 11 10  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  7  1  0  0  0  0
 15  5  1  0  0  0  0
 16  4  2  0  0  0  0
 17  7  2  0  0  0  0
 18 14  1  0  0  0  0
 19  2  1  0  0  0  0
 20 23  2  0  0  0  0
 21 18  1  0  0  0  0
 22 18  2  0  0  0  0
 23 22  1  0  0  0  0
 24 21  2  0  0  0  0
 25  6  1  0  0  0  0
 26 20  1  0  0  0  0
 27  4  1  0  0  0  0
 28 25  1  0  0  0  0
 29 26  1  0  0  0  0
 30 29  1  0  0  0  0
  6  3  2  0  0  0  0
 28 19  1  0  0  0  0
 20 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,413)
2413

>  <Formula> (2,413)
C22H26N2O5S

>  <MolWeight> (2,413)
430.51724

>  <PCAT_CMPD_ID> (2,413)
WAY-330807

>  <CNC_ID> (2,413)
359318162

>  <transfer_container_id> (2,413)
PTN000000065

>  <COMPOUND_NUMBER> (2,413)
WAY-330807

>  <BAR_CODE_NO> (2,413)
305808

>  <LOCATION_CODE> (2,413)
PTNCS

>  <AMOUNT_CURRENT> (2,413)
32.5

$$$$
WAY-332444
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.4375   -5.1125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3 12  2  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  9  2  0  0  0  0
  8 15  1  0  0  0  0
  9  5  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 14  1  0  0  0  0
 13 19  1  0  0  0  0
 14  5  2  0  0  0  0
 15  7  1  0  0  0  0
 16  6  2  0  0  0  0
 17  6  1  0  0  0  0
 18 13  2  0  0  0  0
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 20 13  1  0  0  0  0
 21  4  1  0  0  0  0
 22  4  1  0  0  0  0
 23 22  1  0  0  0  0
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 25 23  1  0  0  0  0
  7  3  1  0  0  0  0
 25 24  1  0  0  0  0
  2  8  1  0  0  0  0
M  END
>  <Mol_ID> (2,414)
2414

>  <Formula> (2,414)
C17H22N2O5S

>  <MolWeight> (2,414)
366.43198

>  <PCAT_CMPD_ID> (2,414)
WAY-332444

>  <CNC_ID> (2,414)
359330980

>  <transfer_container_id> (2,414)
PTN000000067

>  <COMPOUND_NUMBER> (2,414)
WAY-332444

>  <BAR_CODE_NO> (2,414)
307445

>  <LOCATION_CODE> (2,414)
PTNCS

>  <AMOUNT_CURRENT> (2,414)
32.5

$$$$
WAY-333282
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  8 12  2  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
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 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
  6  7  1  0  0  0  0
  9 12  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,415)
2415

>  <Formula> (2,415)
C17H20N2O2

>  <MolWeight> (2,415)
284.3529

>  <PCAT_CMPD_ID> (2,415)
WAY-333282

>  <CNC_ID> (2,415)
359331817

>  <transfer_container_id> (2,415)
PTN000000067

>  <COMPOUND_NUMBER> (2,415)
WAY-333282

>  <BAR_CODE_NO> (2,415)
308283

>  <LOCATION_CODE> (2,415)
PTNCS

>  <AMOUNT_CURRENT> (2,415)
32.5

$$$$
WAY-641978
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 16  4  2  0  0  0  0
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 16 17  1  0  0  0  0
 27 23  2  0  0  0  0
  9  6  1  0  0  0  0
 12 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,416)
2416

>  <Formula> (2,416)
C22H26N2O3

>  <MolWeight> (2,416)
366.45344

>  <PCAT_CMPD_ID> (2,416)
WAY-641978

>  <CNC_ID> (2,416)
359323716

>  <transfer_container_id> (2,416)
PTN000000065

>  <COMPOUND_NUMBER> (2,416)
WAY-641978

>  <BAR_CODE_NO> (2,416)
90476531

>  <LOCATION_CODE> (2,416)
PTNCS

>  <AMOUNT_CURRENT> (2,416)
32.5

$$$$
WAY-332183
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 11  9  2  0  0  0  0
 12  4  1  0  0  0  0
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  6  4  1  0  0  0  0
 22 29  1  0  0  0  0
 14  7  1  0  0  0  0
 27 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,417)
2417

>  <Formula> (2,417)
C24H27N3O3

>  <MolWeight> (2,417)
405.48948

>  <PCAT_CMPD_ID> (2,417)
WAY-332183

>  <CNC_ID> (2,417)
359330719

>  <transfer_container_id> (2,417)
PTN000000067

>  <COMPOUND_NUMBER> (2,417)
WAY-332183

>  <BAR_CODE_NO> (2,417)
307184

>  <LOCATION_CODE> (2,417)
PTNCS

>  <AMOUNT_CURRENT> (2,417)
32.5

$$$$
WAY-624507
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 32 31  2  0  0  0  0
 20 24  2  0  0  0  0
 15  8  2  0  0  0  0
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M  END
>  <Mol_ID> (2,418)
2418

>  <Formula> (2,418)
C23H18N4O3S2

>  <MolWeight> (2,418)
462.54402

>  <PCAT_CMPD_ID> (2,418)
WAY-624507

>  <CNC_ID> (2,418)
359322928

>  <transfer_container_id> (2,418)
PTN000000065

>  <COMPOUND_NUMBER> (2,418)
WAY-624507

>  <BAR_CODE_NO> (2,418)
90458683

>  <LOCATION_CODE> (2,418)
PTNCS

>  <AMOUNT_CURRENT> (2,418)
32.2

$$$$
WAY-333325
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 14  5  1  0  0  0  0
 15  7  1  0  0  0  0
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 17  9  1  0  0  0  0
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  6  9  1  0  0  0  0
 23 17  2  0  0  0  0
 12 19  1  0  0  0  0
 20 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,419)
2419

>  <Formula> (2,419)
C20H18N2O2

>  <MolWeight> (2,419)
318.36912

>  <PCAT_CMPD_ID> (2,419)
WAY-333325

>  <CNC_ID> (2,419)
359331859

>  <transfer_container_id> (2,419)
PTN000000067

>  <COMPOUND_NUMBER> (2,419)
WAY-333325

>  <BAR_CODE_NO> (2,419)
308326

>  <LOCATION_CODE> (2,419)
PTNCS

>  <AMOUNT_CURRENT> (2,419)
32.5

$$$$
WAY-624681
csChFnd80/10111816222D

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 15 12  1  0  0  0  0
 16  7  1  0  0  0  0
 17  9  1  0  0  0  0
 18  2  1  0  0  0  0
 19  2  1  0  0  0  0
 20  2  1  0  0  0  0
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 25 15  1  0  0  0  0
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 27 17  2  0  0  0  0
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 30 28  2  0  0  0  0
 22 16  2  0  0  0  0
 30 29  1  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,420)
2420

>  <Formula> (2,420)
C20H15ClF3NO5

>  <MolWeight> (2,420)
441.7850096

>  <PCAT_CMPD_ID> (2,420)
WAY-624681

>  <CNC_ID> (2,420)
359323102

>  <transfer_container_id> (2,420)
PTN000000065

>  <COMPOUND_NUMBER> (2,420)
WAY-624681

>  <BAR_CODE_NO> (2,420)
90458857

>  <LOCATION_CODE> (2,420)
PTNCS

>  <AMOUNT_CURRENT> (2,420)
32.4

$$$$
WAY-643760
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    0.9042    3.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  3  2  0  0  0  0
  5  1  1  0  0  0  0
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  8  2  1  0  0  0  0
  9 10  2  0  0  0  0
 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  5  2  0  0  0  0
 13 19  1  0  0  0  0
 14  8  1  0  0  0  0
 15  6  1  0  0  0  0
 16  5  1  0  0  0  0
 17 12  1  0  0  0  0
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 21 15  2  0  0  0  0
 22 15  1  0  0  0  0
 23  2  1  0  0  0  0
 24  4  1  0  0  0  0
 25  9  1  0  0  0  0
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 27 22  2  0  0  0  0
 28 21  1  0  0  0  0
 29 26  1  0  0  0  0
 30 12  1  0  0  0  0
 31 29  1  0  0  0  0
 11  8  2  0  0  0  0
 17 18  1  0  0  0  0
  9  6  1  0  0  0  0
 26 28  2  0  0  0  0
M  END
>  <Mol_ID> (2,421)
2421

>  <Formula> (2,421)
C23H24N4O3S

>  <MolWeight> (2,421)
436.52666

>  <PCAT_CMPD_ID> (2,421)
WAY-643760

>  <CNC_ID> (2,421)
359325498

>  <transfer_container_id> (2,421)
PTN000000065

>  <COMPOUND_NUMBER> (2,421)
WAY-643760

>  <BAR_CODE_NO> (2,421)
90478332

>  <LOCATION_CODE> (2,421)
PTNCS

>  <AMOUNT_CURRENT> (2,421)
32.4

$$$$
WAY-624762
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -0.9125    0.3208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  1  0  0  0  0
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  6  7  1  0  0  0  0
  7 15  1  0  0  0  0
  8  1  1  0  0  0  0
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 10  7  2  0  0  0  0
 11 10  1  0  0  0  0
 12  8  2  0  0  0  0
 13  2  1  0  0  0  0
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 15 21  1  0  0  0  0
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 17 14  1  0  0  0  0
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 19  8  1  0  0  0  0
 20 17  1  0  0  0  0
 21 13  1  0  0  0  0
 22 13  2  0  0  0  0
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 24  9  1  0  0  0  0
 25  3  1  0  0  0  0
 26  4  1  0  0  0  0
  2  5  1  0  0  0  0
 16 14  2  0  0  0  0
 20 18  1  0  0  0  0
  9 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,422)
2422

>  <Formula> (2,422)
C17H17N5O3S

>  <MolWeight> (2,422)
371.41358

>  <PCAT_CMPD_ID> (2,422)
WAY-624762

>  <CNC_ID> (2,422)
359323183

>  <transfer_container_id> (2,422)
PTN000000065

>  <COMPOUND_NUMBER> (2,422)
WAY-624762

>  <BAR_CODE_NO> (2,422)
90458939

>  <LOCATION_CODE> (2,422)
PTNCS

>  <AMOUNT_CURRENT> (2,422)
32.7

$$$$
WAY-331418
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   -9.1583    3.8917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  5  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  3  0  0  0  0
 14  4  2  0  0  0  0
 15 11  2  0  0  0  0
 16  7  1  0  0  0  0
 17 15  1  0  0  0  0
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 25 22  2  0  0  0  0
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 27 25  1  0  0  0  0
 12  6  1  0  0  0  0
  5  3  1  0  0  0  0
 27 26  2  0  0  0  0
 20 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,423)
2423

>  <Formula> (2,423)
C21H18FN3OS

>  <MolWeight> (2,423)
379.4505232

>  <PCAT_CMPD_ID> (2,423)
WAY-331418

>  <CNC_ID> (2,423)
359318771

>  <transfer_container_id> (2,423)
PTN000000065

>  <COMPOUND_NUMBER> (2,423)
WAY-331418

>  <BAR_CODE_NO> (2,423)
306419

>  <LOCATION_CODE> (2,423)
PTNCS

>  <AMOUNT_CURRENT> (2,423)
32.5

$$$$
WAY-331416
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  5  1  0  0  0  0
 12  7  1  0  0  0  0
 13 10  3  0  0  0  0
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 15  4  2  0  0  0  0
 16 14  1  0  0  0  0
 17  7  1  0  0  0  0
 18 11  2  0  0  0  0
 19 14  2  0  0  0  0
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 12  6  1  0  0  0  0
  5  3  1  0  0  0  0
 21 20  2  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,424)
2424

>  <Formula> (2,424)
C19H16FN3O2S

>  <MolWeight> (2,424)
369.4126432

>  <PCAT_CMPD_ID> (2,424)
WAY-331416

>  <CNC_ID> (2,424)
359318769

>  <transfer_container_id> (2,424)
PTN000000065

>  <COMPOUND_NUMBER> (2,424)
WAY-331416

>  <BAR_CODE_NO> (2,424)
306417

>  <LOCATION_CODE> (2,424)
PTNCS

>  <AMOUNT_CURRENT> (2,424)
32.5

$$$$
WAY-331434
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 15  5  2  0  0  0  0
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 17  8  2  0  0  0  0
 18  8  1  0  0  0  0
 19  7  1  0  0  0  0
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 12  6  1  0  0  0  0
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 22 21  2  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,425)
2425

>  <Formula> (2,425)
C19H15ClFN3O2S

>  <MolWeight> (2,425)
403.8577032

>  <PCAT_CMPD_ID> (2,425)
WAY-331434

>  <CNC_ID> (2,425)
359318787

>  <transfer_container_id> (2,425)
PTN000000065

>  <COMPOUND_NUMBER> (2,425)
WAY-331434

>  <BAR_CODE_NO> (2,425)
306435

>  <LOCATION_CODE> (2,425)
PTNCS

>  <AMOUNT_CURRENT> (2,425)
32.5

$$$$
WAY-329200
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
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 12  7  1  0  0  0  0
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 14  2  2  0  0  0  0
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 25  5  2  0  0  0  0
 26  6  2  0  0  0  0
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  3  6  1  0  0  0  0
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 32 28  2  0  0  0  0
 22 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,426)
2426

>  <Formula> (2,426)
C24H20N4O4

>  <MolWeight> (2,426)
428.44

>  <PCAT_CMPD_ID> (2,426)
WAY-329200

>  <CNC_ID> (2,426)
359316568

>  <transfer_container_id> (2,426)
PTN000000065

>  <COMPOUND_NUMBER> (2,426)
WAY-329200

>  <BAR_CODE_NO> (2,426)
304201

>  <LOCATION_CODE> (2,426)
PTNCS

>  <AMOUNT_CURRENT> (2,426)
32.5

$$$$
WAY-642762
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  1  0  0  0  0
 12  6  2  0  0  0  0
 13 23  1  0  0  0  0
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 20  2  1  0  0  0  0
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 22  4  1  0  0  0  0
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 13 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,427)
2427

>  <Formula> (2,427)
C18H20FN3O4S

>  <MolWeight> (2,427)
393.4325032

>  <PCAT_CMPD_ID> (2,427)
WAY-642762

>  <CNC_ID> (2,427)
359324500

>  <transfer_container_id> (2,427)
PTN000000065

>  <COMPOUND_NUMBER> (2,427)
WAY-642762

>  <BAR_CODE_NO> (2,427)
90477325

>  <LOCATION_CODE> (2,427)
PTNCS

>  <AMOUNT_CURRENT> (2,427)
32.3

$$$$
WAY-329432
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  3  4  1  0  0  0  0
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 10 11  1  0  0  0  0
 11  2  2  0  0  0  0
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 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
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 18  8  2  0  0  0  0
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  2  3  1  0  0  0  0
 17 13  1  0  0  0  0
  9 10  2  0  0  0  0
 16 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,428)
2428

>  <Formula> (2,428)
C17H17NO3

>  <MolWeight> (2,428)
283.32178

>  <PCAT_CMPD_ID> (2,428)
WAY-329432

>  <CNC_ID> (2,428)
359316800

>  <transfer_container_id> (2,428)
PTN000000065

>  <COMPOUND_NUMBER> (2,428)
WAY-329432

>  <BAR_CODE_NO> (2,428)
304433

>  <LOCATION_CODE> (2,428)
PTNCS

>  <AMOUNT_CURRENT> (2,428)
32.5

$$$$
WAY-642725-A
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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   -1.5458    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1208    3.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5458    3.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3125    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0250    0.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1208   -4.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2625    1.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2625    2.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7417    0.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0250    1.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7417    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  2  2  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  2  0  0  0  0
 13  3  2  0  0  0  0
 14  5  1  0  0  0  0
 15  9  2  0  0  0  0
 16  7  1  0  0  0  0
 17 11  2  0  0  0  0
 18 14  2  0  0  0  0
 19  8  1  0  0  0  0
 20 19  1  0  0  0  0
 21  9  1  0  0  0  0
 22 20  1  0  0  0  0
 23 15  1  0  0  0  0
 24 16  2  0  0  0  0
 25 16  1  0  0  0  0
 26 17  1  0  0  0  0
 27 21  2  0  0  0  0
 28 27  1  0  0  0  0
 29 25  2  0  0  0  0
 30 24  1  0  0  0  0
 31 29  1  0  0  0  0
 18 17  1  0  0  0  0
 31 30  2  0  0  0  0
 22 15  1  0  0  0  0
 28 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,429)
2429

>  <Formula> (2,429)
C25H25N3O3

>  <MolWeight> (2,429)
415.4843

>  <PCAT_CMPD_ID> (2,429)
WAY-642725-A

>  <CNC_ID> (2,429)
359324463

>  <transfer_container_id> (2,429)
PTN000000065

>  <COMPOUND_NUMBER> (2,429)
WAY-642725-A

>  <BAR_CODE_NO> (2,429)
90477288

>  <LOCATION_CODE> (2,429)
PTNCS

>  <AMOUNT_CURRENT> (2,429)
32.5

$$$$
WAY-331610
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   10.2708   -7.1250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.0000   -8.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8875   -7.3625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1125   -7.1250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9500   -8.9750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1750   -8.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7500   -7.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4500   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7500   -7.1250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0250   -8.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5750   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2708   -8.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2625   -5.9625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250   -6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5000   -8.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1750   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9750   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.0875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3375   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3375   -6.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0250   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8000   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7375   -6.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2125   -9.1750    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.9750   -6.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8000   -6.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2125   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6 10  2  0  0  0  0
  7 16  2  0  0  0  0
  8  1  1  0  0  0  0
  9 19  1  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  4  1  0  0  0  0
 15  4  1  0  0  0  0
 16 21  1  0  0  0  0
 17 11  2  0  0  0  0
 18  2  2  0  0  0  0
 19 15  1  0  0  0  0
 20 14  1  0  0  0  0
 21  8  2  0  0  0  0
 22 17  1  0  0  0  0
 23  3  1  0  0  0  0
 24 22  1  0  0  0  0
 25 11  1  0  0  0  0
 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
 20  9  1  0  0  0  0
  7  6  1  0  0  0  0
  2  3  1  0  0  0  0
 27 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,430)
2430

>  <Formula> (2,430)
C18H18ClN3O4S

>  <MolWeight> (2,430)
407.87122

>  <PCAT_CMPD_ID> (2,430)
WAY-331610

>  <CNC_ID> (2,430)
359330148

>  <transfer_container_id> (2,430)
PTN000000067

>  <COMPOUND_NUMBER> (2,430)
WAY-331610

>  <BAR_CODE_NO> (2,430)
306611

>  <LOCATION_CODE> (2,430)
PTNCS

>  <AMOUNT_CURRENT> (2,430)
32.5

$$$$
WAY-331620
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   10.2708   -7.1250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.0000   -8.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8875   -7.3625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1125   -7.1250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9500   -8.9750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1750   -8.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7500   -7.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4500   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0250   -8.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8000   -7.1250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.2625   -5.9625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2708   -8.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250   -6.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5250   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1750   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6500   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -9.0875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3750   -6.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3750   -8.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0250   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0875   -8.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0875   -6.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7375   -6.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3625   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9250   -6.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9500   -8.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2125   -7.1125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  9  2  0  0  0  0
  7 15  2  0  0  0  0
  8  1  1  0  0  0  0
  9  8  1  0  0  0  0
 10 19  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14  4  1  0  0  0  0
 15 20  1  0  0  0  0
 16 10  1  0  0  0  0
 17  2  2  0  0  0  0
 18 13  1  0  0  0  0
 19 14  1  0  0  0  0
 20  8  2  0  0  0  0
 21 16  2  0  0  0  0
 22 16  1  0  0  0  0
 23  3  1  0  0  0  0
 24 25  1  0  0  0  0
 25 22  2  0  0  0  0
 26 21  1  0  0  0  0
 27 24  1  0  0  0  0
 18 10  1  0  0  0  0
  7  6  1  0  0  0  0
  2  3  1  0  0  0  0
 24 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,431)
2431

>  <Formula> (2,431)
C18H18FN3O4S

>  <MolWeight> (2,431)
391.4166232

>  <PCAT_CMPD_ID> (2,431)
WAY-331620

>  <CNC_ID> (2,431)
359330158

>  <transfer_container_id> (2,431)
PTN000000067

>  <COMPOUND_NUMBER> (2,431)
WAY-331620

>  <BAR_CODE_NO> (2,431)
306621

>  <LOCATION_CODE> (2,431)
PTNCS

>  <AMOUNT_CURRENT> (2,431)
32.5

$$$$
WAY-333760
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
  -11.8542    6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8542    7.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5167    5.2542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3417    5.5667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5167    8.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1667    7.5875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2292    6.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1667    6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3417    8.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8042    8.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9042    4.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4542    7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    8.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1333    9.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1250    8.3625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1083    7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0417    8.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4667    6.0292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4250    3.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9250    2.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7750    7.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0000    2.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5000    1.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0667    1.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6667   -0.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  8  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  2  0  0  0  0
  9  2  1  0  0  0  0
 10  6  1  0  0  0  0
 11  4  1  0  0  0  0
 12 10  1  0  0  0  0
 13 23  1  0  0  0  0
 14  5  2  0  0  0  0
 15 13  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  2  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 20 12  2  0  0  0  0
 21 11  1  0  0  0  0
 22 11  2  0  0  0  0
 23 16  1  0  0  0  0
 24 21  2  0  0  0  0
 25 22  1  0  0  0  0
 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
  7  9  2  0  0  0  0
  5  6  1  0  0  0  0
 26 24  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,432)
2432

>  <Formula> (2,432)
C19H17N5O3

>  <MolWeight> (2,432)
363.36998

>  <PCAT_CMPD_ID> (2,432)
WAY-333760

>  <CNC_ID> (2,432)
359332293

>  <transfer_container_id> (2,432)
PTN000000067

>  <COMPOUND_NUMBER> (2,432)
WAY-333760

>  <BAR_CODE_NO> (2,432)
308761

>  <LOCATION_CODE> (2,432)
PTNCS

>  <AMOUNT_CURRENT> (2,432)
32.5

$$$$
WAY-330073
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    4.8425    2.0974    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8425    0.6924    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6304    2.8202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6304    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4243    2.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0567    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4243    0.6924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4810    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2689    2.0974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6304    4.2090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4810    4.2029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8992    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6932    2.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1175    2.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2162    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3296    2.7979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2162    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9053    4.2233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3296    4.2029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5357    2.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  2  0  0  0  0
  8  9  1  0  0  0  0
  9  6  1  0  0  0  0
 10  3  2  0  0  0  0
 11  8  2  0  0  0  0
 12 13  1  0  0  0  0
 13  8  1  0  0  0  0
 14 12  2  0  0  0  0
 15  5  1  0  0  0  0
 16 14  1  0  0  0  0
 17 19  2  0  0  0  0
 18  7  1  0  0  0  0
 19 12  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  1  0  0  0  0
 22 15  2  0  0  0  0
 23 22  1  0  0  0  0
  4  7  1  0  0  0  0
 18 23  2  0  0  0  0
 16 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,433)
2433

>  <Formula> (2,433)
C17H15N3O3

>  <MolWeight> (2,433)
309.3193

>  <PCAT_CMPD_ID> (2,433)
WAY-330073

>  <CNC_ID> (2,433)
359317438

>  <transfer_container_id> (2,433)
PTN000000065

>  <COMPOUND_NUMBER> (2,433)
WAY-330073

>  <BAR_CODE_NO> (2,433)
305074

>  <LOCATION_CODE> (2,433)
PTNCS

>  <AMOUNT_CURRENT> (2,433)
32.5

$$$$
WAY-643585
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.0333   -0.8792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2958   -1.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5000   -0.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5417    1.6833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  7  2  0  0  0  0
  9  1  2  0  0  0  0
 10  1  2  0  0  0  0
 11  7  1  0  0  0  0
 12  4  2  0  0  0  0
 13  8  1  0  0  0  0
 14  6  1  0  0  0  0
 15 11  1  0  0  0  0
 16  3  1  0  0  0  0
 17  2  1  0  0  0  0
 18  6  1  0  0  0  0
 19 14  2  0  0  0  0
 20 14  1  0  0  0  0
 21 22  1  0  0  0  0
 22 17  2  0  0  0  0
 23 20  2  0  0  0  0
 24 19  1  0  0  0  0
 25 23  1  0  0  0  0
 21 16  2  0  0  0  0
 25 24  2  0  0  0  0
 15 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,434)
2434

>  <Formula> (2,434)
C17H15N3O3S2

>  <MolWeight> (2,434)
373.4493

>  <PCAT_CMPD_ID> (2,434)
WAY-643585

>  <CNC_ID> (2,434)
359325323

>  <transfer_container_id> (2,434)
PTN000000065

>  <COMPOUND_NUMBER> (2,434)
WAY-643585

>  <BAR_CODE_NO> (2,434)
90478157

>  <LOCATION_CODE> (2,434)
PTNCS

>  <AMOUNT_CURRENT> (2,434)
32.4

$$$$
WAY-330567
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    4.5917   -4.1167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5917   -4.9417    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8750   -3.7000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  3  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  2  1  0  0  0  0
 10  2  1  0  0  0  0
 11  7  1  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14 13  1  0  0  0  0
 15  4  2  0  0  0  0
 16  6  2  0  0  0  0
 17 18  1  0  0  0  0
 18 23  1  0  0  0  0
 19 14  2  0  0  0  0
 20 17  2  0  0  0  0
 21 12  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
 24 21  2  0  0  0  0
 25 21  1  0  0  0  0
 26 14  1  0  0  0  0
 27 17  1  0  0  0  0
 28 26  1  0  0  0  0
 29 28  1  0  0  0  0
  5  9  1  0  0  0  0
  8  7  1  0  0  0  0
 11 10  2  0  0  0  0
 18 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,435)
2435

>  <Formula> (2,435)
C21H22N2O6

>  <MolWeight> (2,435)
398.40918

>  <PCAT_CMPD_ID> (2,435)
WAY-330567

>  <CNC_ID> (2,435)
359317922

>  <transfer_container_id> (2,435)
PTN000000065

>  <COMPOUND_NUMBER> (2,435)
WAY-330567

>  <BAR_CODE_NO> (2,435)
305568

>  <LOCATION_CODE> (2,435)
PTNCS

>  <AMOUNT_CURRENT> (2,435)
32.5

$$$$
WAY-642236
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    1.5542    0.2208    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.5542   -0.6042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8417   -1.0167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -0.5833   -1.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7333   -0.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6 10  1  0  0  0  0
  7  1  2  0  0  0  0
  8  1  2  0  0  0  0
  9  1  1  0  0  0  0
 10 13  2  0  0  0  0
 11 17  1  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14 11  1  0  0  0  0
 15  4  2  0  0  0  0
 16 12  1  0  0  0  0
 17 19  2  0  0  0  0
 18  2  1  0  0  0  0
 19 13  1  0  0  0  0
 20  3  1  0  0  0  0
 21  9  1  0  0  0  0
 22  9  2  0  0  0  0
 23 18  1  0  0  0  0
 24 23  1  0  0  0  0
 25 22  1  0  0  0  0
 26 21  2  0  0  0  0
 27 25  2  0  0  0  0
 27 26  1  0  0  0  0
 24 20  1  0  0  0  0
 11  6  2  0  0  0  0
 16 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,436)
2436

>  <Formula> (2,436)
C19H20N2O5S

>  <MolWeight> (2,436)
388.4375

>  <PCAT_CMPD_ID> (2,436)
WAY-642236

>  <CNC_ID> (2,436)
359323974

>  <transfer_container_id> (2,436)
PTN000000065

>  <COMPOUND_NUMBER> (2,436)
WAY-642236

>  <BAR_CODE_NO> (2,436)
90476793

>  <LOCATION_CODE> (2,436)
PTNCS

>  <AMOUNT_CURRENT> (2,436)
32.7

$$$$
WAY-331270
csChFnd80/10111816222D

 26 30  0  0  0  0  0  0  0  0999 V2000
   11.8875   -7.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8958   -8.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8958   -5.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1000   -9.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.5500  -10.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8375   -5.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9375   -2.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3375   -2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.4250  -10.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.8500  -13.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3500  -12.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
 12  3  1  0  0  0  0
 13 11  2  0  0  0  0
 14 11  1  0  0  0  0
 15 16  1  0  0  0  0
 16 14  2  0  0  0  0
 17 13  1  0  0  0  0
 18  7  2  0  0  0  0
 19  8  2  0  0  0  0
 20 15  1  0  0  0  0
 21  9  1  0  0  0  0
 22 10  1  0  0  0  0
 23 18  1  0  0  0  0
 24 19  1  0  0  0  0
 25 21  2  0  0  0  0
 26 22  2  0  0  0  0
  8  7  1  0  0  0  0
  9 10  2  0  0  0  0
 15 17  2  0  0  0  0
 24 23  2  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,437)
2437

>  <Formula> (2,437)
C22H15NO2S

>  <MolWeight> (2,437)
357.425

>  <PCAT_CMPD_ID> (2,437)
WAY-331270

>  <CNC_ID> (2,437)
359318625

>  <transfer_container_id> (2,437)
PTN000000065

>  <COMPOUND_NUMBER> (2,437)
WAY-331270

>  <BAR_CODE_NO> (2,437)
306271

>  <LOCATION_CODE> (2,437)
PTNCS

>  <AMOUNT_CURRENT> (2,437)
32.5

$$$$
WAY-624493
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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   -1.6333    1.4083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4875    1.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  8 10  1  0  0  0  0
  9 13  1  0  0  0  0
 10  6  2  0  0  0  0
 11  7  1  0  0  0  0
 12  1  1  0  0  0  0
 13 12  1  0  0  0  0
 14  5  2  0  0  0  0
 15 11  1  0  0  0  0
 16  3  2  0  0  0  0
 17  7  2  0  0  0  0
 18 11  2  0  0  0  0
 19  9  2  0  0  0  0
 20 15  1  0  0  0  0
 21 18  1  0  0  0  0
 22  5  1  0  0  0  0
 23  6  1  0  0  0  0
 24 10  1  0  0  0  0
 25 14  1  0  0  0  0
 26 22  2  0  0  0  0
 27 23  2  0  0  0  0
 28 27  1  0  0  0  0
 29 26  1  0  0  0  0
 14  4  1  0  0  0  0
 29 25  2  0  0  0  0
 28 24  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,438)
2438

>  <Formula> (2,438)
C20H14N4O5

>  <MolWeight> (2,438)
390.34896

>  <PCAT_CMPD_ID> (2,438)
WAY-624493

>  <CNC_ID> (2,438)
359322914

>  <transfer_container_id> (2,438)
PTN000000065

>  <COMPOUND_NUMBER> (2,438)
WAY-624493

>  <BAR_CODE_NO> (2,438)
90458669

>  <LOCATION_CODE> (2,438)
PTNCS

>  <AMOUNT_CURRENT> (2,438)
32.6

$$$$
WAY-332437
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
    7.4375   -5.1125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.6375   -4.8875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3875   -5.1125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6125   -5.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -6.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  1  1  0  0  0  0
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 10  8  1  0  0  0  0
 11 22  1  0  0  0  0
 12  5  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  3  1  0  0  0  0
 16  3  1  0  0  0  0
 17 21  1  0  0  0  0
 18 27  1  0  0  0  0
 19 16  1  0  0  0  0
 20 15  1  0  0  0  0
 21  5  2  0  0  0  0
 22  9  1  0  0  0  0
 23  7  2  0  0  0  0
 24  7  1  0  0  0  0
 25 10  2  0  0  0  0
 26 18  2  0  0  0  0
 27 24  1  0  0  0  0
 28 18  1  0  0  0  0
 29  8  2  0  0  0  0
 30 10  1  0  0  0  0
 31 29  1  0  0  0  0
 32 31  2  0  0  0  0
 33 25  1  0  0  0  0
  9  4  1  0  0  0  0
 20  6  1  0  0  0  0
  2 11  1  0  0  0  0
 32 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,439)
2439

>  <Formula> (2,439)
C24H29N3O5S

>  <MolWeight> (2,439)
471.56916

>  <PCAT_CMPD_ID> (2,439)
WAY-332437

>  <CNC_ID> (2,439)
359330973

>  <transfer_container_id> (2,439)
PTN000000067

>  <COMPOUND_NUMBER> (2,439)
WAY-332437

>  <BAR_CODE_NO> (2,439)
307438

>  <LOCATION_CODE> (2,439)
PTNCS

>  <AMOUNT_CURRENT> (2,439)
32.5

$$$$
WAY-616585
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   -1.0333    1.8500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0333    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3208    3.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3958   -0.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  3  2  0  0  0  0
  7  1  1  0  0  0  0
  8 13  1  0  0  0  0
  9  4  1  0  0  0  0
 10  8  1  0  0  0  0
 11  5  2  0  0  0  0
 12  4  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15 17  1  0  0  0  0
 16 15  2  0  0  0  0
 17 18  1  0  0  0  0
 18 10  1  0  0  0  0
 19 16  1  0  0  0  0
 20  3  1  0  0  0  0
 21  6  1  0  0  0  0
 22 15  1  0  0  0  0
 23 16  1  0  0  0  0
 24 20  2  0  0  0  0
 25 24  1  0  0  0  0
 26 27  1  0  0  0  0
 27 22  2  0  0  0  0
  6  2  1  0  0  0  0
 21 25  2  0  0  0  0
 23 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,440)
2440

>  <Formula> (2,440)
C19H17ClN2O4S

>  <MolWeight> (2,440)
404.86728

>  <PCAT_CMPD_ID> (2,440)
WAY-616585

>  <CNC_ID> (2,440)
359321671

>  <transfer_container_id> (2,440)
PTN000000065

>  <COMPOUND_NUMBER> (2,440)
WAY-616585

>  <BAR_CODE_NO> (2,440)
90450577

>  <LOCATION_CODE> (2,440)
PTNCS

>  <AMOUNT_CURRENT> (2,440)
32.8

$$$$
WAY-329539
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   10.5542   -9.4917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -7.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  8  1  0  0  0  0
  6  3  1  0  0  0  0
  7  2  1  0  0  0  0
  8 16  1  0  0  0  0
  9 12  1  0  0  0  0
 10  8  2  0  0  0  0
 11  1  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  2  0  0  0  0
 14  2  2  0  0  0  0
 15  3  2  0  0  0  0
 16 11  1  0  0  0  0
 17  5  2  0  0  0  0
 18 12  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 21  7  1  0  0  0  0
 22  6  1  0  0  0  0
 23 19  1  0  0  0  0
 24 23  1  0  0  0  0
 25 22  2  0  0  0  0
 26 21  2  0  0  0  0
  6  7  2  0  0  0  0
 26 25  1  0  0  0  0
  4  9  1  0  0  0  0
 19 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,441)
2441

>  <Formula> (2,441)
C20H16N2O4

>  <MolWeight> (2,441)
348.35204

>  <PCAT_CMPD_ID> (2,441)
WAY-329539

>  <CNC_ID> (2,441)
359316907

>  <transfer_container_id> (2,441)
PTN000000065

>  <COMPOUND_NUMBER> (2,441)
WAY-329539

>  <BAR_CODE_NO> (2,441)
304540

>  <LOCATION_CODE> (2,441)
PTNCS

>  <AMOUNT_CURRENT> (2,441)
32.5

$$$$
WAY-330749
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
   12.6875   -2.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5750   -2.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.9250    0.2500    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   15.8125   -0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8 10  1  0  0  0  0
  9  6  2  0  0  0  0
 10 11  1  0  0  0  0
 11  4  1  0  0  0  0
 12  8  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  2  2  0  0  0  0
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
 18 12  1  0  0  0  0
 19  8  2  0  0  0  0
 20 18  2  0  0  0  0
 21  4  1  0  0  0  0
 22 20  1  0  0  0  0
 23 25  1  0  0  0  0
 24 22  1  0  0  0  0
 25 21  1  0  0  0  0
 26 27  2  0  0  0  0
 27 18  1  0  0  0  0
 28 26  1  0  0  0  0
 29 24  1  0  0  0  0
 10 23  1  0  0  0  0
 17  6  1  0  0  0  0
  9  7  1  0  0  0  0
 28 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,442)
2442

>  <Formula> (2,442)
C19H20N4O4S2

>  <MolWeight> (2,442)
432.5165

>  <PCAT_CMPD_ID> (2,442)
WAY-330749

>  <CNC_ID> (2,442)
359318104

>  <transfer_container_id> (2,442)
PTN000000065

>  <COMPOUND_NUMBER> (2,442)
WAY-330749

>  <BAR_CODE_NO> (2,442)
305750

>  <LOCATION_CODE> (2,442)
PTNCS

>  <AMOUNT_CURRENT> (2,442)
32.5

$$$$
WAY-329509
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    3.6421    2.0832    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3558    6.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  6  2  0  0  0  0
  5  1  1  0  0  0  0
  6  5  1  0  0  0  0
  7 14  1  0  0  0  0
  8  2  2  0  0  0  0
  9  3  2  0  0  0  0
 10  5  2  0  0  0  0
 11  7  2  0  0  0  0
 12 13  2  0  0  0  0
 13  9  1  0  0  0  0
 14 19  1  0  0  0  0
 15  7  1  0  0  0  0
 16  6  1  0  0  0  0
 17  8  1  0  0  0  0
 18  9  1  0  0  0  0
 19 16  1  0  0  0  0
 20 15  1  0  0  0  0
 21 15  1  0  0  0  0
 22 18  1  0  0  0  0
 23 17  1  0  0  0  0
 24 21  1  0  0  0  0
 25 20  1  0  0  0  0
 26 24  1  0  0  0  0
  4  2  1  0  0  0  0
 12  8  1  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,443)
2443

>  <Formula> (2,443)
C20H26N2O4

>  <MolWeight> (2,443)
358.43144

>  <PCAT_CMPD_ID> (2,443)
WAY-329509

>  <CNC_ID> (2,443)
359316877

>  <transfer_container_id> (2,443)
PTN000000065

>  <COMPOUND_NUMBER> (2,443)
WAY-329509

>  <BAR_CODE_NO> (2,443)
304510

>  <LOCATION_CODE> (2,443)
PTNCS

>  <AMOUNT_CURRENT> (2,443)
32.5

$$$$
WAY-333231
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    7.3417  -12.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  6  1  0  0  0  0
  5  4  2  0  0  0  0
  6  1  2  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  2  2  0  0  0  0
 10  5  1  0  0  0  0
 11  7  2  0  0  0  0
 12  8  2  0  0  0  0
 13 10  2  0  0  0  0
 14  7  1  0  0  0  0
 15 18  1  0  0  0  0
 16 23  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 16  2  0  0  0  0
 20 16  1  0  0  0  0
 21 14  1  0  0  0  0
 22 15  1  0  0  0  0
 23 21  1  0  0  0  0
 24 22  1  0  0  0  0
  5  3  1  0  0  0  0
 13 12  1  0  0  0  0
 15 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,444)
2444

>  <Formula> (2,444)
C18H17N3O3

>  <MolWeight> (2,444)
323.34588

>  <PCAT_CMPD_ID> (2,444)
WAY-333231

>  <CNC_ID> (2,444)
359331766

>  <transfer_container_id> (2,444)
PTN000000067

>  <COMPOUND_NUMBER> (2,444)
WAY-333231

>  <BAR_CODE_NO> (2,444)
308232

>  <LOCATION_CODE> (2,444)
PTNCS

>  <AMOUNT_CURRENT> (2,444)
32.5

$$$$
WAY-330222
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    8.8875   -4.1000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.8875   -5.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  2  0  0  0  0
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  7  5  1  0  0  0  0
  8 15  1  0  0  0  0
  9  6  2  0  0  0  0
 10  8  1  0  0  0  0
 11  2  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14 11  1  0  0  0  0
 15 22  1  0  0  0  0
 16 14  2  0  0  0  0
 17  4  1  0  0  0  0
 18  4  1  0  0  0  0
 19 10  1  0  0  0  0
 20  8  2  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 19  1  0  0  0  0
 24 10  1  0  0  0  0
 25 23  1  0  0  0  0
 26 23  2  0  0  0  0
 27 24  1  0  0  0  0
 28 25  2  0  0  0  0
 29 26  1  0  0  0  0
 30 29  2  0  0  0  0
 21 15  1  0  0  0  0
 16  6  1  0  0  0  0
  7  9  1  0  0  0  0
 28 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,445)
2445

>  <Formula> (2,445)
C21H24N4O3S2

>  <MolWeight> (2,445)
444.57026

>  <PCAT_CMPD_ID> (2,445)
WAY-330222

>  <CNC_ID> (2,445)
359317587

>  <transfer_container_id> (2,445)
PTN000000065

>  <COMPOUND_NUMBER> (2,445)
WAY-330222

>  <BAR_CODE_NO> (2,445)
305223

>  <LOCATION_CODE> (2,445)
PTNCS

>  <AMOUNT_CURRENT> (2,445)
32.5

$$$$
WAY-329902
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -0.0005   -2.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8306    1.1420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2  4  2  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  6  2  0  0  0  0
 15  1  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
 14 15  1  0  0  0  0
 14 19  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 10  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 12  1  0  0  0  0
 20  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,446)
2446

>  <Formula> (2,446)
C15H20N4O2S

>  <MolWeight> (2,446)
320.4099

>  <PCAT_CMPD_ID> (2,446)
WAY-329902

>  <CNC_ID> (2,446)
359317268

>  <transfer_container_id> (2,446)
PTN000000065

>  <COMPOUND_NUMBER> (2,446)
WAY-329902

>  <BAR_CODE_NO> (2,446)
304903

>  <LOCATION_CODE> (2,446)
PTNCS

>  <AMOUNT_CURRENT> (2,446)
32.5

$$$$
WAY-331331
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    5.2000  -11.4375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.1125  -14.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1000  -13.7125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2000  -13.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
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  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  6  2  0  0  0  0
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 10  9  1  0  0  0  0
 11  2  2  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14 15  1  0  0  0  0
 15 19  2  0  0  0  0
 16 10  1  0  0  0  0
 17 11  1  0  0  0  0
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 25 20  1  0  0  0  0
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  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
 20 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,447)
2447

>  <Formula> (2,447)
C15H12F2N4O3S2

>  <MolWeight> (2,447)
398.4075864

>  <PCAT_CMPD_ID> (2,447)
WAY-331331

>  <CNC_ID> (2,447)
359318686

>  <transfer_container_id> (2,447)
PTN000000065

>  <COMPOUND_NUMBER> (2,447)
WAY-331331

>  <BAR_CODE_NO> (2,447)
306332

>  <LOCATION_CODE> (2,447)
PTNCS

>  <AMOUNT_CURRENT> (2,447)
32.5

$$$$
WAY-624608
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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   -0.3750   -0.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8500   -0.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  2  0  0  0  0
 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
 12  8  1  0  0  0  0
 13 10  2  0  0  0  0
 14  9  1  0  0  0  0
 15 12  1  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
  4  3  2  0  0  0  0
 15 16  1  0  0  0  0
 17 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,448)
2448

>  <Formula> (2,448)
C14H17N3

>  <MolWeight> (2,448)
227.30488

>  <PCAT_CMPD_ID> (2,448)
WAY-624608

>  <CNC_ID> (2,448)
359323029

>  <transfer_container_id> (2,448)
PTN000000065

>  <COMPOUND_NUMBER> (2,448)
WAY-624608

>  <BAR_CODE_NO> (2,448)
90458784

>  <LOCATION_CODE> (2,448)
PTNCS

>  <AMOUNT_CURRENT> (2,448)
32.4

$$$$
WAY-333871
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  8  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
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  7  6  1  0  0  0  0
  8  5  2  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  0  0  0  0
 11  6  1  0  0  0  0
 12  4  2  0  0  0  0
 13 10  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  1  0  0  0  0
 18 13  2  0  0  0  0
 19 13  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22 21  1  0  0  0  0
  7  9  2  0  0  0  0
  3  4  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,449)
2449

>  <Formula> (2,449)
C17H20N4O

>  <MolWeight> (2,449)
296.3669

>  <PCAT_CMPD_ID> (2,449)
WAY-333871

>  <CNC_ID> (2,449)
359332404

>  <transfer_container_id> (2,449)
PTN000000067

>  <COMPOUND_NUMBER> (2,449)
WAY-333871

>  <BAR_CODE_NO> (2,449)
308872

>  <LOCATION_CODE> (2,449)
PTNCS

>  <AMOUNT_CURRENT> (2,449)
32.5

$$$$
WAY-333775
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
  -11.8542    6.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13  5  2  0  0  0  0
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 15 10  2  0  0  0  0
 16 12  2  0  0  0  0
 17 12  1  0  0  0  0
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  7  9  2  0  0  0  0
  5  6  1  0  0  0  0
 20 18  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,450)
2450

>  <Formula> (2,450)
C19H20ClN5O2

>  <MolWeight> (2,450)
385.8474

>  <PCAT_CMPD_ID> (2,450)
WAY-333775

>  <CNC_ID> (2,450)
359332308

>  <transfer_container_id> (2,450)
PTN000000067

>  <COMPOUND_NUMBER> (2,450)
WAY-333775

>  <BAR_CODE_NO> (2,450)
308776

>  <LOCATION_CODE> (2,450)
PTNCS

>  <AMOUNT_CURRENT> (2,450)
32.5

$$$$
WAY-642480
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10 20  1  0  0  0  0
 11  9  2  0  0  0  0
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 15  6  1  0  0  0  0
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  7 11  1  0  0  0  0
 10 21  1  0  0  0  0
 30 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,451)
2451

>  <Formula> (2,451)
C23H28N4O3

>  <MolWeight> (2,451)
408.49342

>  <PCAT_CMPD_ID> (2,451)
WAY-642480

>  <CNC_ID> (2,451)
359324218

>  <transfer_container_id> (2,451)
PTN000000065

>  <COMPOUND_NUMBER> (2,451)
WAY-642480

>  <BAR_CODE_NO> (2,451)
90477040

>  <LOCATION_CODE> (2,451)
PTNCS

>  <AMOUNT_CURRENT> (2,451)
32.9

$$$$
WAY-333741
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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  8  3  2  0  0  0  0
  9  2  1  0  0  0  0
 10  6  1  0  0  0  0
 11 10  1  0  0  0  0
 12  4  1  0  0  0  0
 13  5  2  0  0  0  0
 14 11  2  0  0  0  0
 15 11  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 12  2  0  0  0  0
 19 12  1  0  0  0  0
 20 17  2  0  0  0  0
 21 17  1  0  0  0  0
 22 19  2  0  0  0  0
 23 18  1  0  0  0  0
 24 21  2  0  0  0  0
 25 20  1  0  0  0  0
 26 22  1  0  0  0  0
 27 24  1  0  0  0  0
  7  9  2  0  0  0  0
  5  6  1  0  0  0  0
 23 26  2  0  0  0  0
 25 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,452)
2452

>  <Formula> (2,452)
C20H16N4O3

>  <MolWeight> (2,452)
360.36604

>  <PCAT_CMPD_ID> (2,452)
WAY-333741

>  <CNC_ID> (2,452)
359332274

>  <transfer_container_id> (2,452)
PTN000000067

>  <COMPOUND_NUMBER> (2,452)
WAY-333741

>  <BAR_CODE_NO> (2,452)
308742

>  <LOCATION_CODE> (2,452)
PTNCS

>  <AMOUNT_CURRENT> (2,452)
32.5

$$$$
WAY-642519
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3 10  1  0  0  0  0
  4  3  1  0  0  0  0
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 10 12  1  0  0  0  0
 11  4  1  0  0  0  0
 12 14  1  0  0  0  0
 13  7  1  0  0  0  0
 14  1  1  0  0  0  0
 15  2  2  0  0  0  0
 16 12  2  0  0  0  0
 17  5  1  0  0  0  0
 18 11  1  0  0  0  0
 19 13  1  0  0  0  0
 20 18  1  0  0  0  0
 21 17  2  0  0  0  0
 22 23  1  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
 25 19  2  0  0  0  0
 13  5  2  0  0  0  0
 21 25  1  0  0  0  0
  9 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,453)
2453

>  <Formula> (2,453)
C17H19N5O2S

>  <MolWeight> (2,453)
357.43006

>  <PCAT_CMPD_ID> (2,453)
WAY-642519

>  <CNC_ID> (2,453)
359324257

>  <transfer_container_id> (2,453)
PTN000000065

>  <COMPOUND_NUMBER> (2,453)
WAY-642519

>  <BAR_CODE_NO> (2,453)
90477079

>  <LOCATION_CODE> (2,453)
PTNCS

>  <AMOUNT_CURRENT> (2,453)
32.5

$$$$
WAY-332895
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
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  6  4  2  0  0  0  0
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 10  1  2  0  0  0  0
 11  5  2  0  0  0  0
 12  7  1  0  0  0  0
 13  7  1  0  0  0  0
 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16  9  1  0  0  0  0
 17 13  1  0  0  0  0
 18 12  1  0  0  0  0
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 20 15  2  0  0  0  0
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  5  6  1  0  0  0  0
  9 18  1  0  0  0  0
 21 19  2  0  0  0  0
 28 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,454)
2454

>  <Formula> (2,454)
C22H24N4O2

>  <MolWeight> (2,454)
376.45156

>  <PCAT_CMPD_ID> (2,454)
WAY-332895

>  <CNC_ID> (2,454)
359331430

>  <transfer_container_id> (2,454)
PTN000000067

>  <COMPOUND_NUMBER> (2,454)
WAY-332895

>  <BAR_CODE_NO> (2,454)
307896

>  <LOCATION_CODE> (2,454)
PTNCS

>  <AMOUNT_CURRENT> (2,454)
32.5

$$$$
WAY-332897
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  7  1  0  0  0  0
 12  2  1  0  0  0  0
 13  5  2  0  0  0  0
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 22 20  1  0  0  0  0
  5  6  1  0  0  0  0
  8 15  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,455)
2455

>  <Formula> (2,455)
C16H19N3O3

>  <MolWeight> (2,455)
301.34036

>  <PCAT_CMPD_ID> (2,455)
WAY-332897

>  <CNC_ID> (2,455)
359331432

>  <transfer_container_id> (2,455)
PTN000000067

>  <COMPOUND_NUMBER> (2,455)
WAY-332897

>  <BAR_CODE_NO> (2,455)
307898

>  <LOCATION_CODE> (2,455)
PTNCS

>  <AMOUNT_CURRENT> (2,455)
32.5

$$$$
WAY-331333
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 17  5  1  0  0  0  0
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 29 31  2  0  0  0  0
 28 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,456)
2456

>  <Formula> (2,456)
C21H17ClN4O3S2

>  <MolWeight> (2,456)
472.96768

>  <PCAT_CMPD_ID> (2,456)
WAY-331333

>  <CNC_ID> (2,456)
359318688

>  <transfer_container_id> (2,456)
PTN000000065

>  <COMPOUND_NUMBER> (2,456)
WAY-331333

>  <BAR_CODE_NO> (2,456)
306334

>  <LOCATION_CODE> (2,456)
PTNCS

>  <AMOUNT_CURRENT> (2,456)
32.5

$$$$
WAY-330837
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  3  1  0  0  0  0
 13  3  1  0  0  0  0
 14 18  2  0  0  0  0
 15  6  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  1  0  0  0  0
 18  5  1  0  0  0  0
 19 25  1  0  0  0  0
 20 19  1  0  0  0  0
 21  7  2  0  0  0  0
 22 20  2  0  0  0  0
 23 15  2  0  0  0  0
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 25 24  2  0  0  0  0
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 27  2  1  0  0  0  0
 28  8  1  0  0  0  0
 29  7  1  0  0  0  0
 30 28  1  0  0  0  0
 31 20  1  0  0  0  0
  8  4  2  0  0  0  0
 17  6  1  0  0  0  0
 30 27  1  0  0  0  0
 26 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,457)
2457

>  <Formula> (2,457)
C23H27N3O4S

>  <MolWeight> (2,457)
441.54318

>  <PCAT_CMPD_ID> (2,457)
WAY-330837

>  <CNC_ID> (2,457)
359318192

>  <transfer_container_id> (2,457)
PTN000000065

>  <COMPOUND_NUMBER> (2,457)
WAY-330837

>  <BAR_CODE_NO> (2,457)
305838

>  <LOCATION_CODE> (2,457)
PTNCS

>  <AMOUNT_CURRENT> (2,457)
32.5

$$$$
WAY-332881
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -3.7208    1.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  8  2  1  0  0  0  0
  9  1  2  0  0  0  0
 10  5  2  0  0  0  0
 11 21  1  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14 15  1  0  0  0  0
 15 13  2  0  0  0  0
 16 12  1  0  0  0  0
 17  7  1  0  0  0  0
 18  7  1  0  0  0  0
 19 14  1  0  0  0  0
 20 17  1  0  0  0  0
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 22 19  1  0  0  0  0
  5  6  1  0  0  0  0
 16 14  2  0  0  0  0
 11 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,458)
2458

>  <Formula> (2,458)
C15H17N3O4

>  <MolWeight> (2,458)
303.31318

>  <PCAT_CMPD_ID> (2,458)
WAY-332881

>  <CNC_ID> (2,458)
359331416

>  <transfer_container_id> (2,458)
PTN000000067

>  <COMPOUND_NUMBER> (2,458)
WAY-332881

>  <BAR_CODE_NO> (2,458)
307882

>  <LOCATION_CODE> (2,458)
PTNCS

>  <AMOUNT_CURRENT> (2,458)
32.5

$$$$
WAY-332865
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  2  2  0  0  0  0
 12  5  2  0  0  0  0
 13  7  1  0  0  0  0
 14  7  1  0  0  0  0
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 17  9  2  0  0  0  0
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 26  9  1  0  0  0  0
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 24 19  2  0  0  0  0
  8 16  1  0  0  0  0
 30 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,459)
2459

>  <Formula> (2,459)
C22H23FN4O3

>  <MolWeight> (2,459)
410.4414232

>  <PCAT_CMPD_ID> (2,459)
WAY-332865

>  <CNC_ID> (2,459)
359331400

>  <transfer_container_id> (2,459)
PTN000000067

>  <COMPOUND_NUMBER> (2,459)
WAY-332865

>  <BAR_CODE_NO> (2,459)
307866

>  <LOCATION_CODE> (2,459)
PTNCS

>  <AMOUNT_CURRENT> (2,459)
32.5

$$$$
WAY-329543
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11  5  2  0  0  0  0
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 13  7  2  0  0  0  0
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  4  5  1  0  0  0  0
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 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,460)
2460

>  <Formula> (2,460)
C18H18N2O2S

>  <MolWeight> (2,460)
326.41272

>  <PCAT_CMPD_ID> (2,460)
WAY-329543

>  <CNC_ID> (2,460)
359316911

>  <transfer_container_id> (2,460)
PTN000000065

>  <COMPOUND_NUMBER> (2,460)
WAY-329543

>  <BAR_CODE_NO> (2,460)
304544

>  <LOCATION_CODE> (2,460)
PTNCS

>  <AMOUNT_CURRENT> (2,460)
32.5

$$$$
WAY-616442
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  3  7  1  0  0  0  0
 18 17  2  0  0  0  0
 24 30  2  0  0  0  0
 26 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,461)
2461

>  <Formula> (2,461)
C23H27N3O4

>  <MolWeight> (2,461)
409.47818

>  <PCAT_CMPD_ID> (2,461)
WAY-616442

>  <CNC_ID> (2,461)
359321527

>  <transfer_container_id> (2,461)
PTN000000065

>  <COMPOUND_NUMBER> (2,461)
WAY-616442

>  <BAR_CODE_NO> (2,461)
90450429

>  <LOCATION_CODE> (2,461)
PTNCS

>  <AMOUNT_CURRENT> (2,461)
32.5

$$$$
WAY-623878
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  1  1  0  0  0  0
 12  3  1  0  0  0  0
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  4  3  1  0  0  0  0
 27 24  1  0  0  0  0
 13 19  2  0  0  0  0
  8  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,462)
2462

>  <Formula> (2,462)
C22H21N5O3

>  <MolWeight> (2,462)
403.43384

>  <PCAT_CMPD_ID> (2,462)
WAY-623878

>  <CNC_ID> (2,462)
359322498

>  <transfer_container_id> (2,462)
PTN000000065

>  <COMPOUND_NUMBER> (2,462)
WAY-623878

>  <BAR_CODE_NO> (2,462)
90458049

>  <LOCATION_CODE> (2,462)
PTNCS

>  <AMOUNT_CURRENT> (2,462)
32.7

$$$$
WAY-333226
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  8  1  0  0  0  0
 12  4  2  0  0  0  0
 13  6  1  0  0  0  0
 14  9  2  0  0  0  0
 15 13  2  0  0  0  0
 16 11  1  0  0  0  0
 17 11  1  0  0  0  0
 18 16  2  0  0  0  0
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 20 18  1  0  0  0  0
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 22 21  1  0  0  0  0
  6  3  1  0  0  0  0
 15 14  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,463)
2463

>  <Formula> (2,463)
C17H15N3O2

>  <MolWeight> (2,463)
293.3199

>  <PCAT_CMPD_ID> (2,463)
WAY-333226

>  <CNC_ID> (2,463)
359331761

>  <transfer_container_id> (2,463)
PTN000000067

>  <COMPOUND_NUMBER> (2,463)
WAY-333226

>  <BAR_CODE_NO> (2,463)
308227

>  <LOCATION_CODE> (2,463)
PTNCS

>  <AMOUNT_CURRENT> (2,463)
32.5

$$$$
WAY-641847
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  8  2  0  0  0  0
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 26 20  2  0  0  0  0
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M  END
>  <Mol_ID> (2,464)
2464

>  <Formula> (2,464)
C20H20N2O4

>  <MolWeight> (2,464)
352.3838

>  <PCAT_CMPD_ID> (2,464)
WAY-641847

>  <CNC_ID> (2,464)
359323585

>  <transfer_container_id> (2,464)
PTN000000065

>  <COMPOUND_NUMBER> (2,464)
WAY-641847

>  <BAR_CODE_NO> (2,464)
90476400

>  <LOCATION_CODE> (2,464)
PTNCS

>  <AMOUNT_CURRENT> (2,464)
32.4

$$$$
WAY-329428
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
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  5  2  1  0  0  0  0
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  7  1  1  0  0  0  0
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  9  7  2  0  0  0  0
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 11  9  1  0  0  0  0
 12  5  2  0  0  0  0
 13  5  1  0  0  0  0
 14  6  2  0  0  0  0
 15 12  1  0  0  0  0
 16 13  2  0  0  0  0
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 20  9  1  0  0  0  0
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 10  6  1  0  0  0  0
  8 11  2  0  0  0  0
 22 21  1  0  0  0  0
 18 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,465)
2465

>  <Formula> (2,465)
C18H15F2NO

>  <MolWeight> (2,465)
299.3146064

>  <PCAT_CMPD_ID> (2,465)
WAY-329428

>  <CNC_ID> (2,465)
359316796

>  <transfer_container_id> (2,465)
PTN000000065

>  <COMPOUND_NUMBER> (2,465)
WAY-329428

>  <BAR_CODE_NO> (2,465)
304429

>  <LOCATION_CODE> (2,465)
PTNCS

>  <AMOUNT_CURRENT> (2,465)
32.5

$$$$
WAY-329447
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  7  2  0  0  0  0
 10  2  1  0  0  0  0
 11  9  1  0  0  0  0
 12  5  2  0  0  0  0
 13  5  1  0  0  0  0
 14  6  2  0  0  0  0
 15 12  1  0  0  0  0
 16 13  2  0  0  0  0
 17 12  1  0  0  0  0
 18 16  1  0  0  0  0
 19 16  1  0  0  0  0
 20  9  1  0  0  0  0
 21 11  1  0  0  0  0
 22 20  1  0  0  0  0
  6 10  1  0  0  0  0
 11  8  2  0  0  0  0
 21 22  1  0  0  0  0
 15 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,466)
2466

>  <Formula> (2,466)
C18H15BrFNO

>  <MolWeight> (2,466)
360.2202032

>  <PCAT_CMPD_ID> (2,466)
WAY-329447

>  <CNC_ID> (2,466)
359316815

>  <transfer_container_id> (2,466)
PTN000000065

>  <COMPOUND_NUMBER> (2,466)
WAY-329447

>  <BAR_CODE_NO> (2,466)
304448

>  <LOCATION_CODE> (2,466)
PTNCS

>  <AMOUNT_CURRENT> (2,466)
32.5

$$$$
WAY-643412
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5 12  1  0  0  0  0
  6 11  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  2  0  0  0  0
  9  1  2  0  0  0  0
 10  6  1  0  0  0  0
 11 21  1  0  0  0  0
 12 10  1  0  0  0  0
 13  3  2  0  0  0  0
 14  7  1  0  0  0  0
 15  6  2  0  0  0  0
 16  5  2  0  0  0  0
 17 13  1  0  0  0  0
 18  4  2  0  0  0  0
 19  4  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22  2  1  0  0  0  0
 23  2  1  0  0  0  0
 24 23  1  0  0  0  0
 25 22  1  0  0  0  0
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 27 24  1  0  0  0  0
 11 20  2  0  0  0  0
 26 27  1  0  0  0  0
 14 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,467)
2467

>  <Formula> (2,467)
C19H22N2O5S

>  <MolWeight> (2,467)
390.45338

>  <PCAT_CMPD_ID> (2,467)
WAY-643412

>  <CNC_ID> (2,467)
359325150

>  <transfer_container_id> (2,467)
PTN000000065

>  <COMPOUND_NUMBER> (2,467)
WAY-643412

>  <BAR_CODE_NO> (2,467)
90477984

>  <LOCATION_CODE> (2,467)
PTNCS

>  <AMOUNT_CURRENT> (2,467)
33

$$$$
WAY-331446
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
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 10  1  1  0  0  0  0
 11 10  1  0  0  0  0
 12  5  1  0  0  0  0
 13  7  1  0  0  0  0
 14 12  1  0  0  0  0
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 18 15  1  0  0  0  0
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 22 13  2  0  0  0  0
 23 21  2  0  0  0  0
 24 18  1  0  0  0  0
  7 11  2  0  0  0  0
  5  6  2  0  0  0  0
 20 22  1  0  0  0  0
 23 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,468)
2468

>  <Formula> (2,468)
C16H11FN4O2S

>  <MolWeight> (2,468)
342.3475432

>  <PCAT_CMPD_ID> (2,468)
WAY-331446

>  <CNC_ID> (2,468)
359318798

>  <transfer_container_id> (2,468)
PTN000000065

>  <COMPOUND_NUMBER> (2,468)
WAY-331446

>  <BAR_CODE_NO> (2,468)
306447

>  <LOCATION_CODE> (2,468)
PTNCS

>  <AMOUNT_CURRENT> (2,468)
32.5

$$$$
WAY-329093
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 13  8  1  0  0  0  0
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 15  4  1  0  0  0  0
 16  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,469)
2469

>  <Formula> (2,469)
C22H19N3O2

>  <MolWeight> (2,469)
357.40516

>  <PCAT_CMPD_ID> (2,469)
WAY-329093

>  <CNC_ID> (2,469)
359316458

>  <transfer_container_id> (2,469)
PTN000000065

>  <COMPOUND_NUMBER> (2,469)
WAY-329093

>  <BAR_CODE_NO> (2,469)
304094

>  <LOCATION_CODE> (2,469)
PTNCS

>  <AMOUNT_CURRENT> (2,469)
32.5

$$$$
WAY-329094
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,470)
2470

>  <Formula> (2,470)
C23H21N3O2

>  <MolWeight> (2,470)
371.43174

>  <PCAT_CMPD_ID> (2,470)
WAY-329094

>  <CNC_ID> (2,470)
359316459

>  <transfer_container_id> (2,470)
PTN000000065

>  <COMPOUND_NUMBER> (2,470)
WAY-329094

>  <BAR_CODE_NO> (2,470)
304095

>  <LOCATION_CODE> (2,470)
PTNCS

>  <AMOUNT_CURRENT> (2,470)
32.5

$$$$
WAY-329101
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,471)
2471

>  <Formula> (2,471)
C24H23N3O3

>  <MolWeight> (2,471)
401.45772

>  <PCAT_CMPD_ID> (2,471)
WAY-329101

>  <CNC_ID> (2,471)
359316466

>  <transfer_container_id> (2,471)
PTN000000065

>  <COMPOUND_NUMBER> (2,471)
WAY-329101

>  <BAR_CODE_NO> (2,471)
304102

>  <LOCATION_CODE> (2,471)
PTNCS

>  <AMOUNT_CURRENT> (2,471)
32.5

$$$$
WAY-329099
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,472)
2472

>  <Formula> (2,472)
C24H23N3O4

>  <MolWeight> (2,472)
417.45712

>  <PCAT_CMPD_ID> (2,472)
WAY-329099

>  <CNC_ID> (2,472)
359316464

>  <transfer_container_id> (2,472)
PTN000000065

>  <COMPOUND_NUMBER> (2,472)
WAY-329099

>  <BAR_CODE_NO> (2,472)
304100

>  <LOCATION_CODE> (2,472)
PTNCS

>  <AMOUNT_CURRENT> (2,472)
32.5

$$$$
WAY-278759
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,473)
2473

>  <Formula> (2,473)
C13H10N2O4S2

>  <MolWeight> (2,473)
322.3595

>  <PCAT_CMPD_ID> (2,473)
WAY-278759

>  <CNC_ID> (2,473)
359327479

>  <transfer_container_id> (2,473)
PTN000000067

>  <COMPOUND_NUMBER> (2,473)
WAY-278759

>  <BAR_CODE_NO> (2,473)
389414

>  <LOCATION_CODE> (2,473)
PTNCS

>  <AMOUNT_CURRENT> (2,473)
32.5

$$$$
WAY-329087
csChFnd80/10111816222D

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 10  6  1  0  0  0  0
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 13  5  1  0  0  0  0
 14 10  1  0  0  0  0
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  5  4  2  0  0  0  0
 21 22  1  0  0  0  0
 28 25  1  0  0  0  0
 27 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,474)
2474

>  <Formula> (2,474)
C24H22N2O2

>  <MolWeight> (2,474)
370.44368

>  <PCAT_CMPD_ID> (2,474)
WAY-329087

>  <CNC_ID> (2,474)
359316452

>  <transfer_container_id> (2,474)
PTN000000065

>  <COMPOUND_NUMBER> (2,474)
WAY-329087

>  <BAR_CODE_NO> (2,474)
304088

>  <LOCATION_CODE> (2,474)
PTNCS

>  <AMOUNT_CURRENT> (2,474)
32.5

$$$$
WAY-330093
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  4  1  0  0  0  0
 12  1  1  0  0  0  0
 13  9  2  0  0  0  0
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 11 18  2  0  0  0  0
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 22 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,475)
2475

>  <Formula> (2,475)
C26H31N3O4

>  <MolWeight> (2,475)
449.54204

>  <PCAT_CMPD_ID> (2,475)
WAY-330093

>  <CNC_ID> (2,475)
359317458

>  <transfer_container_id> (2,475)
PTN000000065

>  <COMPOUND_NUMBER> (2,475)
WAY-330093

>  <BAR_CODE_NO> (2,475)
305094

>  <LOCATION_CODE> (2,475)
PTNCS

>  <AMOUNT_CURRENT> (2,475)
32.5

$$$$
WAY-331481
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
   -4.2490    0.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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  3 11  1  0  0  0  0
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 16 17  1  0  0  0  0
 12 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,476)
2476

>  <Formula> (2,476)
C12H14N2O2S

>  <MolWeight> (2,476)
250.31676

>  <PCAT_CMPD_ID> (2,476)
WAY-331481

>  <CNC_ID> (2,476)
359318832

>  <transfer_container_id> (2,476)
PTN000000065

>  <COMPOUND_NUMBER> (2,476)
WAY-331481

>  <BAR_CODE_NO> (2,476)
306482

>  <LOCATION_CODE> (2,476)
PTNCS

>  <AMOUNT_CURRENT> (2,476)
32.5

$$$$
WAY-278800
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  4  1  0  0  0  0
 12  7  1  0  0  0  0
 13  6  1  0  0  0  0
 14  8  1  0  0  0  0
 15  8  1  0  0  0  0
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  6  3  2  0  0  0  0
 13  9  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,477)
2477

>  <Formula> (2,477)
C16H19N3OS

>  <MolWeight> (2,477)
301.40656

>  <PCAT_CMPD_ID> (2,477)
WAY-278800

>  <CNC_ID> (2,477)
359327520

>  <transfer_container_id> (2,477)
PTN000000067

>  <COMPOUND_NUMBER> (2,477)
WAY-278800

>  <BAR_CODE_NO> (2,477)
389455

>  <LOCATION_CODE> (2,477)
PTNCS

>  <AMOUNT_CURRENT> (2,477)
32.5

$$$$
WAY-278573
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,478)
2478

>  <Formula> (2,478)
C12H11FN2O2S

>  <MolWeight> (2,478)
266.2913432

>  <PCAT_CMPD_ID> (2,478)
WAY-278573

>  <CNC_ID> (2,478)
359327293

>  <transfer_container_id> (2,478)
PTN000000067

>  <COMPOUND_NUMBER> (2,478)
WAY-278573

>  <BAR_CODE_NO> (2,478)
389228

>  <LOCATION_CODE> (2,478)
PTNCS

>  <AMOUNT_CURRENT> (2,478)
32.5

$$$$
WAY-331478
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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  4  2  1  0  0  0  0
  5  1  1  0  0  0  0
  6  3  1  0  0  0  0
  7  4  1  0  0  0  0
  8  7  1  0  0  0  0
  9  5  1  0  0  0  0
 10  5  1  0  0  0  0
 11  6  1  0  0  0  0
 12 11  2  0  0  0  0
 13  7  2  0  0  0  0
 14 10  1  0  0  0  0
 15  9  1  0  0  0  0
 16 14  1  0  0  0  0
  6  4  2  0  0  0  0
 16 15  1  0  0  0  0
 13 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,479)
2479

>  <Formula> (2,479)
C12H13FN2S

>  <MolWeight> (2,479)
236.3084232

>  <PCAT_CMPD_ID> (2,479)
WAY-331478

>  <CNC_ID> (2,479)
359318829

>  <transfer_container_id> (2,479)
PTN000000065

>  <COMPOUND_NUMBER> (2,479)
WAY-331478

>  <BAR_CODE_NO> (2,479)
306479

>  <LOCATION_CODE> (2,479)
PTNCS

>  <AMOUNT_CURRENT> (2,479)
32.5

$$$$
WAY-278485
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
    0.0042    1.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  5  6  1  0  0  0  0
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  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
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 10  4  1  0  0  0  0
 11  5  2  0  0  0  0
 12 11  1  0  0  0  0
 13  6  2  0  0  0  0
 14  8  1  0  0  0  0
 15  9  1  0  0  0  0
 16 10  1  0  0  0  0
 17 16  2  0  0  0  0
 18 14  2  0  0  0  0
 19 14  1  0  0  0  0
 10  8  2  0  0  0  0
 17 18  1  0  0  0  0
 12  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,480)
2480

>  <Formula> (2,480)
C13H9ClN2OS2

>  <MolWeight> (2,480)
308.80636

>  <PCAT_CMPD_ID> (2,480)
WAY-278485

>  <CNC_ID> (2,480)
359327205

>  <transfer_container_id> (2,480)
PTN000000067

>  <COMPOUND_NUMBER> (2,480)
WAY-278485

>  <BAR_CODE_NO> (2,480)
389139

>  <LOCATION_CODE> (2,480)
PTNCS

>  <AMOUNT_CURRENT> (2,480)
32.5

$$$$
WAY-623578
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
   -0.1208    0.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  6  5  2  0  0  0  0
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  8  2  2  0  0  0  0
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 10 16  1  0  0  0  0
 11  7  1  0  0  0  0
 12  4  1  0  0  0  0
 13  4  1  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16 13  1  0  0  0  0
 17 12  1  0  0  0  0
 18 14  2  0  0  0  0
 19 18  1  0  0  0  0
 10 17  1  0  0  0  0
  3  6  1  0  0  0  0
 19 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,481)
2481

>  <Formula> (2,481)
C14H13ClN2O2

>  <MolWeight> (2,481)
276.71822

>  <PCAT_CMPD_ID> (2,481)
WAY-623578

>  <CNC_ID> (2,481)
359322198

>  <transfer_container_id> (2,481)
PTN000000065

>  <COMPOUND_NUMBER> (2,481)
WAY-623578

>  <BAR_CODE_NO> (2,481)
90457747

>  <LOCATION_CODE> (2,481)
PTNCS

>  <AMOUNT_CURRENT> (2,481)
32.9

$$$$
WAY-278470
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    3.2484    0.9168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3277    0.1755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  6  9  2  0  0  0  0
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 10 11  1  0  0  0  0
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 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
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 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
 17 18  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,482)
2482

>  <Formula> (2,482)
C18H17N3O4S2

>  <MolWeight> (2,482)
403.47528

>  <PCAT_CMPD_ID> (2,482)
WAY-278470

>  <CNC_ID> (2,482)
359327190

>  <transfer_container_id> (2,482)
PTN000000067

>  <COMPOUND_NUMBER> (2,482)
WAY-278470

>  <BAR_CODE_NO> (2,482)
389124

>  <LOCATION_CODE> (2,482)
PTNCS

>  <AMOUNT_CURRENT> (2,482)
32.5

$$$$
WAY-663377
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.6083   -0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  3  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  1  0  0  0  0
 16 14  2  0  0  0  0
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 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
  9 12  1  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,483)
2483

>  <Formula> (2,483)
C16H17ClN2O

>  <MolWeight> (2,483)
288.77198

>  <PCAT_CMPD_ID> (2,483)
WAY-663377

>  <CNC_ID> (2,483)
359326280

>  <transfer_container_id> (2,483)
PTN000000065

>  <COMPOUND_NUMBER> (2,483)
WAY-663377

>  <BAR_CODE_NO> (2,483)
90498124

>  <LOCATION_CODE> (2,483)
PTNCS

>  <AMOUNT_CURRENT> (2,483)
32.5

$$$$
WAY-624936
csChFnd80/10111816222D

 12 13  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
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 10  3  1  0  0  0  0
 11  5  1  0  0  0  0
 12 10  1  0  0  0  0
  9  6  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,484)
2484

>  <Formula> (2,484)
C8H12N2O2

>  <MolWeight> (2,484)
168.19308

>  <PCAT_CMPD_ID> (2,484)
WAY-624936

>  <CNC_ID> (2,484)
359323357

>  <transfer_container_id> (2,484)
PTN000000065

>  <COMPOUND_NUMBER> (2,484)
WAY-624936

>  <BAR_CODE_NO> (2,484)
90459116

>  <LOCATION_CODE> (2,484)
PTNCS

>  <AMOUNT_CURRENT> (2,484)
32

$$$$
WAY-624734
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 18  8  1  0  0  0  0
 19  5  1  0  0  0  0
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 29 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,485)
2485

>  <Formula> (2,485)
C21H28N2O4S2

>  <MolWeight> (2,485)
436.58802

>  <PCAT_CMPD_ID> (2,485)
WAY-624734

>  <CNC_ID> (2,485)
359323155

>  <transfer_container_id> (2,485)
PTN000000065

>  <COMPOUND_NUMBER> (2,485)
WAY-624734

>  <BAR_CODE_NO> (2,485)
90458911

>  <LOCATION_CODE> (2,485)
PTNCS

>  <AMOUNT_CURRENT> (2,485)
32.9

$$$$
WAY-642864
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
 12  4  1  0  0  0  0
 13  3  1  0  0  0  0
 14 13  1  0  0  0  0
 15  3  1  0  0  0  0
 16 15  1  0  0  0  0
 17  2  2  0  0  0  0
 18  4  2  0  0  0  0
 19 12  1  0  0  0  0
 20  9  1  0  0  0  0
 21 11  1  0  0  0  0
 22 11  1  0  0  0  0
 23 19  1  0  0  0  0
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 22 10  1  0  0  0  0
  9 21  1  0  0  0  0
 20 10  1  0  0  0  0
 14  5  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,486)
2486

>  <Formula> (2,486)
C20H30N2O3

>  <MolWeight> (2,486)
346.4638

>  <PCAT_CMPD_ID> (2,486)
WAY-642864

>  <CNC_ID> (2,486)
359324602

>  <transfer_container_id> (2,486)
PTN000000065

>  <COMPOUND_NUMBER> (2,486)
WAY-642864

>  <BAR_CODE_NO> (2,486)
90477428

>  <LOCATION_CODE> (2,486)
PTNCS

>  <AMOUNT_CURRENT> (2,486)
32.9

$$$$
WAY-642510
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  3  1  0  0  0  0
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 14  8  1  0  0  0  0
 15  4  2  0  0  0  0
 16  9  2  0  0  0  0
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 20  7  1  0  0  0  0
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 22  2  1  0  0  0  0
 23 10  1  0  0  0  0
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 25 24  1  0  0  0  0
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 25 23  2  0  0  0  0
 14 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,487)
2487

>  <Formula> (2,487)
C17H19FN2O3S2

>  <MolWeight> (2,487)
382.4727632

>  <PCAT_CMPD_ID> (2,487)
WAY-642510

>  <CNC_ID> (2,487)
359324248

>  <transfer_container_id> (2,487)
PTN000000065

>  <COMPOUND_NUMBER> (2,487)
WAY-642510

>  <BAR_CODE_NO> (2,487)
90477070

>  <LOCATION_CODE> (2,487)
PTNCS

>  <AMOUNT_CURRENT> (2,487)
32.6

$$$$
WAY-624571
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
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 12  4  1  0  0  0  0
 13  8  1  0  0  0  0
 14  7  1  0  0  0  0
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 17  2  2  0  0  0  0
 18  5  2  0  0  0  0
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 24  6  1  0  0  0  0
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 26  9  1  0  0  0  0
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  9  6  2  0  0  0  0
 29 30  1  0  0  0  0
 14 10  1  0  0  0  0
 19 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,488)
2488

>  <Formula> (2,488)
C22H27N3O5

>  <MolWeight> (2,488)
413.46688

>  <PCAT_CMPD_ID> (2,488)
WAY-624571

>  <CNC_ID> (2,488)
359322992

>  <transfer_container_id> (2,488)
PTN000000065

>  <COMPOUND_NUMBER> (2,488)
WAY-624571

>  <BAR_CODE_NO> (2,488)
90458747

>  <LOCATION_CODE> (2,488)
PTNCS

>  <AMOUNT_CURRENT> (2,488)
32.2

$$$$
WAY-333285
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,489)
2489

>  <Formula> (2,489)
C15H17N3O2

>  <MolWeight> (2,489)
271.31438

>  <PCAT_CMPD_ID> (2,489)
WAY-333285

>  <CNC_ID> (2,489)
359331820

>  <transfer_container_id> (2,489)
PTN000000067

>  <COMPOUND_NUMBER> (2,489)
WAY-333285

>  <BAR_CODE_NO> (2,489)
308286

>  <LOCATION_CODE> (2,489)
PTNCS

>  <AMOUNT_CURRENT> (2,489)
32.5

$$$$
WAY-278570
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11 14  2  0  0  0  0
 12  3  2  0  0  0  0
 13 11  1  0  0  0  0
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 15  9  1  0  0  0  0
 16  8  1  0  0  0  0
 17 10  1  0  0  0  0
 18 13  2  0  0  0  0
 19 17  2  0  0  0  0
 20 18  1  0  0  0  0
 21  7  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
 16  7  1  0  0  0  0
 10 11  1  0  0  0  0
 19 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,490)
2490

>  <Formula> (2,490)
C17H22N2O3S

>  <MolWeight> (2,490)
334.43318

>  <PCAT_CMPD_ID> (2,490)
WAY-278570

>  <CNC_ID> (2,490)
359327290

>  <transfer_container_id> (2,490)
PTN000000067

>  <COMPOUND_NUMBER> (2,490)
WAY-278570

>  <BAR_CODE_NO> (2,490)
389225

>  <LOCATION_CODE> (2,490)
PTNCS

>  <AMOUNT_CURRENT> (2,490)
32.5

$$$$
WAY-332970
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
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  7 12  1  0  0  0  0
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 10  3  1  0  0  0  0
 11 13  1  0  0  0  0
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 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 15  4  2  0  0  0  0
 16  8  2  0  0  0  0
 17 10  1  0  0  0  0
 18  8  1  0  0  0  0
 19 17  1  0  0  0  0
 20 10  2  0  0  0  0
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 26 24  2  0  0  0  0
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 21 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,491)
2491

>  <Formula> (2,491)
C18H23N3O5

>  <MolWeight> (2,491)
361.39232

>  <PCAT_CMPD_ID> (2,491)
WAY-332970

>  <CNC_ID> (2,491)
359331505

>  <transfer_container_id> (2,491)
PTN000000067

>  <COMPOUND_NUMBER> (2,491)
WAY-332970

>  <BAR_CODE_NO> (2,491)
307971

>  <LOCATION_CODE> (2,491)
PTNCS

>  <AMOUNT_CURRENT> (2,491)
32.5

$$$$
WAY-663688
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
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 10 15  2  0  0  0  0
 11  4  2  0  0  0  0
 12  4  1  0  0  0  0
 13 22  1  0  0  0  0
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 15 13  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  2  0  0  0  0
 18 14  1  0  0  0  0
 19  9  1  0  0  0  0
 20  5  1  0  0  0  0
 21  7  1  0  0  0  0
 22 19  1  0  0  0  0
 14 16  2  0  0  0  0
  3  2  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,492)
2492

>  <Formula> (2,492)
C17H16FNO3

>  <MolWeight> (2,492)
301.3122432

>  <PCAT_CMPD_ID> (2,492)
WAY-663688

>  <CNC_ID> (2,492)
359326592

>  <transfer_container_id> (2,492)
PTN000000065

>  <COMPOUND_NUMBER> (2,492)
WAY-663688

>  <BAR_CODE_NO> (2,492)
90498436

>  <LOCATION_CODE> (2,492)
PTNCS

>  <AMOUNT_CURRENT> (2,492)
32.2

$$$$
WAY-643685
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  7  2  0  0  0  0
 12  9  1  0  0  0  0
 13 14  2  0  0  0  0
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 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17  2  1  0  0  0  0
 18  2  1  0  0  0  0
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 20  6  1  0  0  0  0
 21 20  2  0  0  0  0
 22 21  1  0  0  0  0
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 25 17  1  0  0  0  0
 22 12  2  0  0  0  0
 15 13  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,493)
2493

>  <Formula> (2,493)
C20H23BrN2O2

>  <MolWeight> (2,493)
403.31282

>  <PCAT_CMPD_ID> (2,493)
WAY-643685

>  <CNC_ID> (2,493)
359325423

>  <transfer_container_id> (2,493)
PTN000000065

>  <COMPOUND_NUMBER> (2,493)
WAY-643685

>  <BAR_CODE_NO> (2,493)
90478257

>  <LOCATION_CODE> (2,493)
PTNCS

>  <AMOUNT_CURRENT> (2,493)
32.6

$$$$
WAY-616778
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
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 15  1  1  0  0  0  0
 16  1  1  0  0  0  0
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 23 21  1  0  0  0  0
 18  4  1  0  0  0  0
  6  2  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,494)
2494

>  <Formula> (2,494)
C19H23NO3

>  <MolWeight> (2,494)
313.39082

>  <PCAT_CMPD_ID> (2,494)
WAY-616778

>  <CNC_ID> (2,494)
359321864

>  <transfer_container_id> (2,494)
PTN000000065

>  <COMPOUND_NUMBER> (2,494)
WAY-616778

>  <BAR_CODE_NO> (2,494)
90450774

>  <LOCATION_CODE> (2,494)
PTNCS

>  <AMOUNT_CURRENT> (2,494)
32.1

$$$$
WAY-330598
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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  5  7  1  0  0  0  0
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 17 18  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,495)
2495

>  <Formula> (2,495)
C16H11NO4

>  <MolWeight> (2,495)
281.26284

>  <PCAT_CMPD_ID> (2,495)
WAY-330598

>  <CNC_ID> (2,495)
359317953

>  <transfer_container_id> (2,495)
PTN000000065

>  <COMPOUND_NUMBER> (2,495)
WAY-330598

>  <BAR_CODE_NO> (2,495)
305599

>  <LOCATION_CODE> (2,495)
PTNCS

>  <AMOUNT_CURRENT> (2,495)
32.5

$$$$
WAY-642726-A
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,496)
2496

>  <Formula> (2,496)
C21H24N2O3

>  <MolWeight> (2,496)
352.42686

>  <PCAT_CMPD_ID> (2,496)
WAY-642726-A

>  <CNC_ID> (2,496)
359324464

>  <transfer_container_id> (2,496)
PTN000000065

>  <COMPOUND_NUMBER> (2,496)
WAY-642726-A

>  <BAR_CODE_NO> (2,496)
90477289

>  <LOCATION_CODE> (2,496)
PTNCS

>  <AMOUNT_CURRENT> (2,496)
33

$$$$
WAY-643590
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,497)
2497

>  <Formula> (2,497)
C23H26N2O5S

>  <MolWeight> (2,497)
442.52794

>  <PCAT_CMPD_ID> (2,497)
WAY-643590

>  <CNC_ID> (2,497)
359325328

>  <transfer_container_id> (2,497)
PTN000000065

>  <COMPOUND_NUMBER> (2,497)
WAY-643590

>  <BAR_CODE_NO> (2,497)
90478162

>  <LOCATION_CODE> (2,497)
PTNCS

>  <AMOUNT_CURRENT> (2,497)
32.2

$$$$
WAY-624667
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,498)
2498

>  <Formula> (2,498)
C21H27N3O5

>  <MolWeight> (2,498)
401.45618

>  <PCAT_CMPD_ID> (2,498)
WAY-624667

>  <CNC_ID> (2,498)
359323088

>  <transfer_container_id> (2,498)
PTN000000065

>  <COMPOUND_NUMBER> (2,498)
WAY-624667

>  <BAR_CODE_NO> (2,498)
90458843

>  <LOCATION_CODE> (2,498)
PTNCS

>  <AMOUNT_CURRENT> (2,498)
32.8

$$$$
WAY-333306
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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   -0.2458   14.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8958    3.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8667    8.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3667    3.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5292   16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2292    7.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9542    5.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  2  0  0  0  0
  9 15  1  0  0  0  0
 10  2  2  0  0  0  0
 11  4  2  0  0  0  0
 12  6  1  0  0  0  0
 13  6  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16  3  1  0  0  0  0
 17  7  1  0  0  0  0
 18  8  1  0  0  0  0
 19  9  1  0  0  0  0
 20 17  2  0  0  0  0
 21 20  1  0  0  0  0
  5  8  1  0  0  0  0
 18 21  2  0  0  0  0
  9 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,499)
2499

>  <Formula> (2,499)
C16H19N3O2

>  <MolWeight> (2,499)
285.34096

>  <PCAT_CMPD_ID> (2,499)
WAY-333306

>  <CNC_ID> (2,499)
359331840

>  <transfer_container_id> (2,499)
PTN000000067

>  <COMPOUND_NUMBER> (2,499)
WAY-333306

>  <BAR_CODE_NO> (2,499)
308307

>  <LOCATION_CODE> (2,499)
PTNCS

>  <AMOUNT_CURRENT> (2,499)
32.5

$$$$
WAY-333309
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -5.1833    5.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9583    7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5625    3.7958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8458    7.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2167   13.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5500    3.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4667   15.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.5667   15.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  1  1  0  0  0  0
  8 15  1  0  0  0  0
  9  8  1  0  0  0  0
 10  7  2  0  0  0  0
 11  2  2  0  0  0  0
 12  4  2  0  0  0  0
 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
 19  3  1  0  0  0  0
 20  7  1  0  0  0  0
 21 10  1  0  0  0  0
 22 18  1  0  0  0  0
 23 20  2  0  0  0  0
 24 23  1  0  0  0  0
 25 22  1  0  0  0  0
  5 10  1  0  0  0  0
 24 21  2  0  0  0  0
  8 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,500)
2500

>  <Formula> (2,500)
C18H21N3O4

>  <MolWeight> (2,500)
343.37704

>  <PCAT_CMPD_ID> (2,500)
WAY-333309

>  <CNC_ID> (2,500)
359331843

>  <transfer_container_id> (2,500)
PTN000000067

>  <COMPOUND_NUMBER> (2,500)
WAY-333309

>  <BAR_CODE_NO> (2,500)
308310

>  <LOCATION_CODE> (2,500)
PTNCS

>  <AMOUNT_CURRENT> (2,500)
32.5

$$$$
WAY-624939
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
    0.3292   -0.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3292   -0.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0750   -1.2042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0958    2.4583    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3833    1.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0833   -2.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  2  0  0  0  0
  8  1  1  0  0  0  0
  9  3  1  0  0  0  0
 10 12  1  0  0  0  0
 11  5  1  0  0  0  0
 12 11  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 14  1  0  0  0  0
 13 15  1  0  0  0  0
 10  4  2  0  0  0  0
M  END
>  <Mol_ID> (2,501)
2501

>  <Formula> (2,501)
C12H17N3

>  <MolWeight> (2,501)
203.28348

>  <PCAT_CMPD_ID> (2,501)
WAY-624939

>  <CNC_ID> (2,501)
359323360

>  <transfer_container_id> (2,501)
PTN000000065

>  <COMPOUND_NUMBER> (2,501)
WAY-624939

>  <BAR_CODE_NO> (2,501)
90459119

>  <LOCATION_CODE> (2,501)
PTNCS

>  <AMOUNT_CURRENT> (2,501)
32.9

$$$$
WAY-624938
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
    0.0042    1.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2458    0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4750    1.9583    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3500   -2.2917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4583   -2.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7583   -1.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7917    2.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0083   -1.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  6  2  1  0  0  0  0
  7  5  2  0  0  0  0
  8  1  1  0  0  0  0
  9  3  1  0  0  0  0
 10 13  1  0  0  0  0
 11  5  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  2  0  0  0  0
  9 12  1  0  0  0  0
 10  4  2  0  0  0  0
M  END
>  <Mol_ID> (2,502)
2502

>  <Formula> (2,502)
C10H13N3

>  <MolWeight> (2,502)
175.23032

>  <PCAT_CMPD_ID> (2,502)
WAY-624938

>  <CNC_ID> (2,502)
359323359

>  <transfer_container_id> (2,502)
PTN000000065

>  <COMPOUND_NUMBER> (2,502)
WAY-624938

>  <BAR_CODE_NO> (2,502)
90459118

>  <LOCATION_CODE> (2,502)
PTNCS

>  <AMOUNT_CURRENT> (2,502)
32.7

$$$$
WAY-624482
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
    2.0417   -0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4750   -0.8417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
  5  1  1  0  0  0  0
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  9 20  1  0  0  0  0
 10 19  1  0  0  0  0
 11  8  1  0  0  0  0
 12  5  1  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  9  1  0  0  0  0
 16 21  2  0  0  0  0
 17  5  2  0  0  0  0
 18  9  2  0  0  0  0
 19 23  2  0  0  0  0
 20 12  1  0  0  0  0
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 22 15  1  0  0  0  0
 23 21  1  0  0  0  0
 24  3  1  0  0  0  0
 25  4  1  0  0  0  0
 26  6  1  0  0  0  0
 27  7  1  0  0  0  0
 28 24  1  0  0  0  0
 29 25  1  0  0  0  0
 30 26  2  0  0  0  0
 31 30  1  0  0  0  0
 32 28  1  0  0  0  0
  2  4  1  0  0  0  0
 31 27  2  0  0  0  0
 29 32  1  0  0  0  0
 10  8  2  0  0  0  0
 14 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,503)
2503

>  <Formula> (2,503)
C25H24N2O5

>  <MolWeight> (2,503)
432.46846

>  <PCAT_CMPD_ID> (2,503)
WAY-624482

>  <CNC_ID> (2,503)
359322903

>  <transfer_container_id> (2,503)
PTN000000065

>  <COMPOUND_NUMBER> (2,503)
WAY-624482

>  <BAR_CODE_NO> (2,503)
90458658

>  <LOCATION_CODE> (2,503)
PTNCS

>  <AMOUNT_CURRENT> (2,503)
32.7

$$$$
WAY-616648
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
    0.6208   -0.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6208   -2.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0917   -1.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0917   -1.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 11  1  0  0  0  0
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 17 12  1  0  0  0  0
 18  3  1  0  0  0  0
 19  4  1  0  0  0  0
 20  6  1  0  0  0  0
 21 18  1  0  0  0  0
 22  7  1  0  0  0  0
 23 20  2  0  0  0  0
 24 23  1  0  0  0  0
  4  2  1  0  0  0  0
 21 19  1  0  0  0  0
 22 24  2  0  0  0  0
 15 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,504)
2504

>  <Formula> (2,504)
C20H17FN2O

>  <MolWeight> (2,504)
320.3601832

>  <PCAT_CMPD_ID> (2,504)
WAY-616648

>  <CNC_ID> (2,504)
359321734

>  <transfer_container_id> (2,504)
PTN000000065

>  <COMPOUND_NUMBER> (2,504)
WAY-616648

>  <BAR_CODE_NO> (2,504)
90450640

>  <LOCATION_CODE> (2,504)
PTNCS

>  <AMOUNT_CURRENT> (2,504)
33

$$$$
WAY-624917
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
    0.3625   -0.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  7  1  0  0  0  0
 12 10  2  0  0  0  0
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  6  5  1  0  0  0  0
 13 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,505)
2505

>  <Formula> (2,505)
C10H12N2O

>  <MolWeight> (2,505)
176.21508

>  <PCAT_CMPD_ID> (2,505)
WAY-624917

>  <CNC_ID> (2,505)
359323338

>  <transfer_container_id> (2,505)
PTN000000065

>  <COMPOUND_NUMBER> (2,505)
WAY-624917

>  <BAR_CODE_NO> (2,505)
90459097

>  <LOCATION_CODE> (2,505)
PTNCS

>  <AMOUNT_CURRENT> (2,505)
32.2

$$$$
WAY-329897
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10 14  2  0  0  0  0
 11 20  1  0  0  0  0
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 13  9  1  0  0  0  0
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 17 11  2  0  0  0  0
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 19  6  1  0  0  0  0
 20 13  1  0  0  0  0
  3  5  1  0  0  0  0
 10 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,506)
2506

>  <Formula> (2,506)
C13H16ClN3O2S

>  <MolWeight> (2,506)
313.80304

>  <PCAT_CMPD_ID> (2,506)
WAY-329897

>  <CNC_ID> (2,506)
359317263

>  <transfer_container_id> (2,506)
PTN000000065

>  <COMPOUND_NUMBER> (2,506)
WAY-329897

>  <BAR_CODE_NO> (2,506)
304898

>  <LOCATION_CODE> (2,506)
PTNCS

>  <AMOUNT_CURRENT> (2,506)
32.5

$$$$
WAY-624873
csChFnd80/10111816222D

 13 14  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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  4  6  2  0  0  0  0
  5  2  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
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 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12 13  1  0  0  0  0
 13 10  2  0  0  0  0
  8 11  1  0  0  0  0
 12  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,507)
2507

>  <Formula> (2,507)
C10H13N3

>  <MolWeight> (2,507)
175.23032

>  <PCAT_CMPD_ID> (2,507)
WAY-624873

>  <CNC_ID> (2,507)
359323294

>  <transfer_container_id> (2,507)
PTN000000065

>  <COMPOUND_NUMBER> (2,507)
WAY-624873

>  <BAR_CODE_NO> (2,507)
90459051

>  <LOCATION_CODE> (2,507)
PTNCS

>  <AMOUNT_CURRENT> (2,507)
33

$$$$
WAY-329838
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
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 14  5  2  0  0  0  0
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 17  6  2  0  0  0  0
 18 12  1  0  0  0  0
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 10  9  1  0  0  0  0
 19 24  1  0  0  0  0
 21 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,508)
2508

>  <Formula> (2,508)
C19H26ClN3O2

>  <MolWeight> (2,508)
363.88164

>  <PCAT_CMPD_ID> (2,508)
WAY-329838

>  <CNC_ID> (2,508)
359317204

>  <transfer_container_id> (2,508)
PTN000000065

>  <COMPOUND_NUMBER> (2,508)
WAY-329838

>  <BAR_CODE_NO> (2,508)
304839

>  <LOCATION_CODE> (2,508)
PTNCS

>  <AMOUNT_CURRENT> (2,508)
32.5

$$$$
WAY-624439
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 11  6  2  0  0  0  0
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 26  9  2  0  0  0  0
 27 14  2  0  0  0  0
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M  END
>  <Mol_ID> (2,509)
2509

>  <Formula> (2,509)
C20H20F3N3O3

>  <MolWeight> (2,509)
407.3863096

>  <PCAT_CMPD_ID> (2,509)
WAY-624439

>  <CNC_ID> (2,509)
359322860

>  <transfer_container_id> (2,509)
PTN000000065

>  <COMPOUND_NUMBER> (2,509)
WAY-624439

>  <BAR_CODE_NO> (2,509)
90458614

>  <LOCATION_CODE> (2,509)
PTNCS

>  <AMOUNT_CURRENT> (2,509)
32.5

$$$$
WAY-329143
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  7 17  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  9  2  0  0  0  0
 13  2  2  0  0  0  0
 14  6  1  0  0  0  0
 15  6  1  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18  4  2  0  0  0  0
 19  8  1  0  0  0  0
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 23  3  1  0  0  0  0
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 26 25  1  0  0  0  0
 20 19  2  0  0  0  0
 16  7  1  0  0  0  0
 26 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,510)
2510

>  <Formula> (2,510)
C17H20ClN3O3S2

>  <MolWeight> (2,510)
413.942

>  <PCAT_CMPD_ID> (2,510)
WAY-329143

>  <CNC_ID> (2,510)
359316508

>  <transfer_container_id> (2,510)
PTN000000065

>  <COMPOUND_NUMBER> (2,510)
WAY-329143

>  <BAR_CODE_NO> (2,510)
304144

>  <LOCATION_CODE> (2,510)
PTNCS

>  <AMOUNT_CURRENT> (2,510)
32.5

$$$$
WAY-641879
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  6  1  0  0  0  0
 12  1  1  0  0  0  0
 13  4  1  0  0  0  0
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 16 10  2  0  0  0  0
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 30 27  1  0  0  0  0
 29 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,511)
2511

>  <Formula> (2,511)
C27H24N2O

>  <MolWeight> (2,511)
392.49226

>  <PCAT_CMPD_ID> (2,511)
WAY-641879

>  <CNC_ID> (2,511)
359323617

>  <transfer_container_id> (2,511)
PTN000000065

>  <COMPOUND_NUMBER> (2,511)
WAY-641879

>  <BAR_CODE_NO> (2,511)
90476432

>  <LOCATION_CODE> (2,511)
PTNCS

>  <AMOUNT_CURRENT> (2,511)
32

$$$$
WAY-641880
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  7  2  0  0  0  0
 12  1  1  0  0  0  0
 13  1  1  0  0  0  0
 14  1  1  0  0  0  0
 15  7  1  0  0  0  0
 16  9  1  0  0  0  0
 17  8  1  0  0  0  0
 18 20  1  0  0  0  0
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 27  4  1  0  0  0  0
 17  5  1  0  0  0  0
 18 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,512)
2512

>  <Formula> (2,512)
C22H26F3N3O2

>  <MolWeight> (2,512)
421.4559496

>  <PCAT_CMPD_ID> (2,512)
WAY-641880

>  <CNC_ID> (2,512)
359323618

>  <transfer_container_id> (2,512)
PTN000000065

>  <COMPOUND_NUMBER> (2,512)
WAY-641880

>  <BAR_CODE_NO> (2,512)
90476433

>  <LOCATION_CODE> (2,512)
PTNCS

>  <AMOUNT_CURRENT> (2,512)
32.4

$$$$
WAY-330906
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  4  2  0  0  0  0
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 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
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 19  9  1  0  0  0  0
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  8  5  1  0  0  0  0
 17 14  1  0  0  0  0
 25 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,513)
2513

>  <Formula> (2,513)
C19H20N2O4

>  <MolWeight> (2,513)
340.3731

>  <PCAT_CMPD_ID> (2,513)
WAY-330906

>  <CNC_ID> (2,513)
359318261

>  <transfer_container_id> (2,513)
PTN000000065

>  <COMPOUND_NUMBER> (2,513)
WAY-330906

>  <BAR_CODE_NO> (2,513)
305907

>  <LOCATION_CODE> (2,513)
PTNCS

>  <AMOUNT_CURRENT> (2,513)
32.5

$$$$
WAY-663009
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  4  1  0  0  0  0
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 13  2  2  0  0  0  0
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 16  9  1  0  0  0  0
 17  9  2  0  0  0  0
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 22  7  1  0  0  0  0
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 10  7  2  0  0  0  0
  5 15  1  0  0  0  0
 24 25  1  0  0  0  0
 19 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,514)
2514

>  <Formula> (2,514)
C19H19FN2O3

>  <MolWeight> (2,514)
342.3641632

>  <PCAT_CMPD_ID> (2,514)
WAY-663009

>  <CNC_ID> (2,514)
359325912

>  <transfer_container_id> (2,514)
PTN000000065

>  <COMPOUND_NUMBER> (2,514)
WAY-663009

>  <BAR_CODE_NO> (2,514)
90497756

>  <LOCATION_CODE> (2,514)
PTNCS

>  <AMOUNT_CURRENT> (2,514)
32.2

$$$$
WAY-642744
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 13  5  1  0  0  0  0
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 28  6  1  0  0  0  0
 15  8  2  0  0  0  0
 32 33  1  0  0  0  0
M  END
>  <Mol_ID> (2,515)
2515

>  <Formula> (2,515)
C23H27N3O7S

>  <MolWeight> (2,515)
489.54138

>  <PCAT_CMPD_ID> (2,515)
WAY-642744

>  <CNC_ID> (2,515)
359324482

>  <transfer_container_id> (2,515)
PTN000000065

>  <COMPOUND_NUMBER> (2,515)
WAY-642744

>  <BAR_CODE_NO> (2,515)
90477307

>  <LOCATION_CODE> (2,515)
PTNCS

>  <AMOUNT_CURRENT> (2,515)
32.5

$$$$
WAY-643282
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10 25  1  0  0  0  0
 11  3  2  0  0  0  0
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M  END
>  <Mol_ID> (2,516)
2516

>  <Formula> (2,516)
C21H24N4O4

>  <MolWeight> (2,516)
396.43966

>  <PCAT_CMPD_ID> (2,516)
WAY-643282

>  <CNC_ID> (2,516)
359325020

>  <transfer_container_id> (2,516)
PTN000000065

>  <COMPOUND_NUMBER> (2,516)
WAY-643282

>  <BAR_CODE_NO> (2,516)
90477853

>  <LOCATION_CODE> (2,516)
PTNCS

>  <AMOUNT_CURRENT> (2,516)
33

$$$$
WAY-623714
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  1  1  0  0  0  0
 11  8  2  0  0  0  0
 12  7  2  0  0  0  0
 13  5  1  0  0  0  0
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  3  6  2  0  0  0  0
 12 11  1  0  0  0  0
M  END
>  <Mol_ID> (2,517)
2517

>  <Formula> (2,517)
C9H8ClN3O

>  <MolWeight> (2,517)
209.63232

>  <PCAT_CMPD_ID> (2,517)
WAY-623714

>  <CNC_ID> (2,517)
359322334

>  <transfer_container_id> (2,517)
PTN000000065

>  <COMPOUND_NUMBER> (2,517)
WAY-623714

>  <BAR_CODE_NO> (2,517)
90457883

>  <LOCATION_CODE> (2,517)
PTNCS

>  <AMOUNT_CURRENT> (2,517)
32.5

$$$$
WAY-330595
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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  4  5  1  0  0  0  0
 22  6  1  0  0  0  0
 11 25  2  0  0  0  0
 18 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,518)
2518

>  <Formula> (2,518)
C23H21F2N3O5

>  <MolWeight> (2,518)
457.4267464

>  <PCAT_CMPD_ID> (2,518)
WAY-330595

>  <CNC_ID> (2,518)
359317950

>  <transfer_container_id> (2,518)
PTN000000065

>  <COMPOUND_NUMBER> (2,518)
WAY-330595

>  <BAR_CODE_NO> (2,518)
305596

>  <LOCATION_CODE> (2,518)
PTNCS

>  <AMOUNT_CURRENT> (2,518)
32.5

$$$$
WAY-330932
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
    9.4000   -3.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6875   -3.3917    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292   -4.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9042   -4.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2625   -5.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2167   -4.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5917   -0.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9917    0.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0167   -5.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6542   -1.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.0167   -6.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.8000   -0.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -0.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  9  1  0  0  0  0
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  7 16  1  0  0  0  0
  8  7  1  0  0  0  0
  9  3  2  0  0  0  0
 10  4  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  2  0  0  0  0
 13 11  1  0  0  0  0
 14 11  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 17  4  2  0  0  0  0
 18  8  2  0  0  0  0
 19 10  1  0  0  0  0
 20  8  1  0  0  0  0
 21  5  2  0  0  0  0
 22 26  1  0  0  0  0
 23 19  2  0  0  0  0
 24 19  1  0  0  0  0
 25 23  1  0  0  0  0
 26 24  2  0  0  0  0
 27  9  1  0  0  0  0
 28 27  2  0  0  0  0
 29 20  1  0  0  0  0
 30 22  1  0  0  0  0
 31 30  1  0  0  0  0
 32 29  1  0  0  0  0
  6  5  1  0  0  0  0
 28 21  1  0  0  0  0
 15  7  1  0  0  0  0
 22 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,519)
2519

>  <Formula> (2,519)
C25H29N3O4

>  <MolWeight> (2,519)
435.51546

>  <PCAT_CMPD_ID> (2,519)
WAY-330932

>  <CNC_ID> (2,519)
359318287

>  <transfer_container_id> (2,519)
PTN000000065

>  <COMPOUND_NUMBER> (2,519)
WAY-330932

>  <BAR_CODE_NO> (2,519)
305933

>  <LOCATION_CODE> (2,519)
PTNCS

>  <AMOUNT_CURRENT> (2,519)
32.5

$$$$
WAY-332972
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
   -3.1833    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1833    2.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  9  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  2  0  0  0  0
 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  3  1  0  0  0  0
 14  8  2  0  0  0  0
 15 10  2  0  0  0  0
 16 13  1  0  0  0  0
 17 21  1  0  0  0  0
 18 16  2  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
 21 19  2  0  0  0  0
 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
 24 17  1  0  0  0  0
 25 23  1  0  0  0  0
 26 22  1  0  0  0  0
 27 25  1  0  0  0  0
  5  6  2  0  0  0  0
  7  8  1  0  0  0  0
 20 17  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,520)
2520

>  <Formula> (2,520)
C19H22N6O2

>  <MolWeight> (2,520)
366.41698

>  <PCAT_CMPD_ID> (2,520)
WAY-332972

>  <CNC_ID> (2,520)
359331507

>  <transfer_container_id> (2,520)
PTN000000067

>  <COMPOUND_NUMBER> (2,520)
WAY-332972

>  <BAR_CODE_NO> (2,520)
307973

>  <LOCATION_CODE> (2,520)
PTNCS

>  <AMOUNT_CURRENT> (2,520)
32.5

$$$$
WAY-333021
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -3.1833    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  9  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  2  0  0  0  0
 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  3  1  0  0  0  0
 14  8  2  0  0  0  0
 15 10  2  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18 20  2  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 21 12  1  0  0  0  0
 22 12  1  0  0  0  0
 23 18  1  0  0  0  0
 24 23  1  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
  7  8  1  0  0  0  0
  5  4  2  0  0  0  0
 18 19  1  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,521)
2521

>  <Formula> (2,521)
C17H18N6O3

>  <MolWeight> (2,521)
354.36322

>  <PCAT_CMPD_ID> (2,521)
WAY-333021

>  <CNC_ID> (2,521)
359331556

>  <transfer_container_id> (2,521)
PTN000000067

>  <COMPOUND_NUMBER> (2,521)
WAY-333021

>  <BAR_CODE_NO> (2,521)
308022

>  <LOCATION_CODE> (2,521)
PTNCS

>  <AMOUNT_CURRENT> (2,521)
32.5

$$$$
WAY-332804
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    6.4792    0.4708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  1  2  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6  1  1  0  0  0  0
  7 14  1  0  0  0  0
  8  1  1  0  0  0  0
  9  5  1  0  0  0  0
 10  3  1  0  0  0  0
 11  2  1  0  0  0  0
 12  5  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15  8  2  0  0  0  0
 16  9  1  0  0  0  0
 17 10  1  0  0  0  0
 18 10  1  0  0  0  0
 19  8  1  0  0  0  0
 20 11  1  0  0  0  0
 21 11  2  0  0  0  0
 22 16  1  0  0  0  0
 23 16  1  0  0  0  0
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 25 20  2  0  0  0  0
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 27 26  2  0  0  0  0
  4  2  1  0  0  0  0
  7 13  1  0  0  0  0
 27 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,522)
2522

>  <Formula> (2,522)
C20H25N3O4

>  <MolWeight> (2,522)
371.4302

>  <PCAT_CMPD_ID> (2,522)
WAY-332804

>  <CNC_ID> (2,522)
359331340

>  <transfer_container_id> (2,522)
PTN000000067

>  <COMPOUND_NUMBER> (2,522)
WAY-332804

>  <BAR_CODE_NO> (2,522)
307805

>  <LOCATION_CODE> (2,522)
PTNCS

>  <AMOUNT_CURRENT> (2,522)
32.5

$$$$
WAY-624136
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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  5  1  1  0  0  0  0
  6  5  2  0  0  0  0
  7  9  1  0  0  0  0
  8  1  1  0  0  0  0
  9 12  1  0  0  0  0
 10  7  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  2  0  0  0  0
 13 15  1  0  0  0  0
 14 23  1  0  0  0  0
 15 19  1  0  0  0  0
 16  8  1  0  0  0  0
 17  4  2  0  0  0  0
 18  8  2  0  0  0  0
 19 16  1  0  0  0  0
 20 10  2  0  0  0  0
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 22 11  1  0  0  0  0
 23 21  2  0  0  0  0
 24 15  2  0  0  0  0
 25  3  1  0  0  0  0
 26  5  1  0  0  0  0
 27  6  1  0  0  0  0
 28 25  1  0  0  0  0
 29 26  2  0  0  0  0
 30 29  1  0  0  0  0
  4  3  1  0  0  0  0
 30 27  2  0  0  0  0
 14  9  2  0  0  0  0
 10 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,523)
2523

>  <Formula> (2,523)
C21H17N3O6

>  <MolWeight> (2,523)
407.37618

>  <PCAT_CMPD_ID> (2,523)
WAY-624136

>  <CNC_ID> (2,523)
359322755

>  <transfer_container_id> (2,523)
PTN000000065

>  <COMPOUND_NUMBER> (2,523)
WAY-624136

>  <BAR_CODE_NO> (2,523)
90458311

>  <LOCATION_CODE> (2,523)
PTNCS

>  <AMOUNT_CURRENT> (2,523)
32

$$$$
WAY-330796
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
   12.0500   -4.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4000   -3.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6750   -2.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0208   -5.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.9000   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3250   -2.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3500   -4.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0500   -6.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000   -4.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3250   -0.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9 12  1  0  0  0  0
 10  7  1  0  0  0  0
 11  6  2  0  0  0  0
 12 10  2  0  0  0  0
 13 15  1  0  0  0  0
 14  8  2  0  0  0  0
 15 17  2  0  0  0  0
 16  2  1  0  0  0  0
 17 10  1  0  0  0  0
 18  5  1  0  0  0  0
 19  9  1  0  0  0  0
 20  8  1  0  0  0  0
 21 13  1  0  0  0  0
  3  5  2  0  0  0  0
 13  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,524)
2524

>  <Formula> (2,524)
C17H20N2O2

>  <MolWeight> (2,524)
284.3529

>  <PCAT_CMPD_ID> (2,524)
WAY-330796

>  <CNC_ID> (2,524)
359318151

>  <transfer_container_id> (2,524)
PTN000000065

>  <COMPOUND_NUMBER> (2,524)
WAY-330796

>  <BAR_CODE_NO> (2,524)
305797

>  <LOCATION_CODE> (2,524)
PTNCS

>  <AMOUNT_CURRENT> (2,524)
32.5

$$$$
WAY-330795
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   12.0500   -4.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4000   -3.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.6750   -2.6125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5000   -1.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3750   -5.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0208   -5.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4125   -5.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -2.8500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.0500   -0.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000   -7.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8 16  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11  9  2  0  0  0  0
 12  6  2  0  0  0  0
 13  9  1  0  0  0  0
 14  7  1  0  0  0  0
 15  7  1  0  0  0  0
 16 15  1  0  0  0  0
 17 14  1  0  0  0  0
 18 10  2  0  0  0  0
 19 13  2  0  0  0  0
 20 11  1  0  0  0  0
 21  2  1  0  0  0  0
 22  5  1  0  0  0  0
 23 19  1  0  0  0  0
 24 20  1  0  0  0  0
 25 10  1  0  0  0  0
 26 13  1  0  0  0  0
  4  5  2  0  0  0  0
 17  8  1  0  0  0  0
 23 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,525)
2525

>  <Formula> (2,525)
C20H24ClN3O2

>  <MolWeight> (2,525)
373.87646

>  <PCAT_CMPD_ID> (2,525)
WAY-330795

>  <CNC_ID> (2,525)
359318150

>  <transfer_container_id> (2,525)
PTN000000065

>  <COMPOUND_NUMBER> (2,525)
WAY-330795

>  <BAR_CODE_NO> (2,525)
305796

>  <LOCATION_CODE> (2,525)
PTNCS

>  <AMOUNT_CURRENT> (2,525)
32.5

$$$$
WAY-623962
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -0.4583    1.4083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  4  2  0  0  0  0
  7  5  1  0  0  0  0
  8 11  1  0  0  0  0
  9  7  1  0  0  0  0
 10  2  1  0  0  0  0
 11  9  1  0  0  0  0
 12  8  2  0  0  0  0
 13  7  2  0  0  0  0
 14 12  1  0  0  0  0
 15  8  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18 12  1  0  0  0  0
 19 15  2  0  0  0  0
 20 16  2  0  0  0  0
 21 17  1  0  0  0  0
 22 19  1  0  0  0  0
 23 21  2  0  0  0  0
  3  6  1  0  0  0  0
 23 20  1  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,526)
2526

>  <Formula> (2,526)
C18H15FN2OS

>  <MolWeight> (2,526)
326.3879032

>  <PCAT_CMPD_ID> (2,526)
WAY-623962

>  <CNC_ID> (2,526)
359322582

>  <transfer_container_id> (2,526)
PTN000000065

>  <COMPOUND_NUMBER> (2,526)
WAY-623962

>  <BAR_CODE_NO> (2,526)
90458135

>  <LOCATION_CODE> (2,526)
PTNCS

>  <AMOUNT_CURRENT> (2,526)
32.2

$$$$
WAY-329010
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
    2.8167   -8.9750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  4  1  0  0  0  0
  9  3  2  0  0  0  0
 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
 12 11  2  0  0  0  0
 13  5  1  0  0  0  0
 14  2  1  0  0  0  0
 15 12  1  0  0  0  0
 16 15  1  0  0  0  0
 17 18  2  0  0  0  0
 18 11  1  0  0  0  0
 19 17  1  0  0  0  0
 20 16  1  0  0  0  0
 21 13  1  0  0  0  0
 22 13  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
  8  6  1  0  0  0  0
 19 15  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,527)
2527

>  <Formula> (2,527)
C19H26N2O3

>  <MolWeight> (2,527)
330.42134

>  <PCAT_CMPD_ID> (2,527)
WAY-329010

>  <CNC_ID> (2,527)
359316375

>  <transfer_container_id> (2,527)
PTN000000065

>  <COMPOUND_NUMBER> (2,527)
WAY-329010

>  <BAR_CODE_NO> (2,527)
304011

>  <LOCATION_CODE> (2,527)
PTNCS

>  <AMOUNT_CURRENT> (2,527)
32.5

$$$$
WAY-329020
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
    3.0792   -9.1875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2917   -7.2500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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 10  4  2  0  0  0  0
 11  7  1  0  0  0  0
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 13  5  1  0  0  0  0
 14  2  1  0  0  0  0
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 25 23  1  0  0  0  0
  8  6  1  0  0  0  0
 19 15  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,528)
2528

>  <Formula> (2,528)
C20H28N2O3

>  <MolWeight> (2,528)
344.44792

>  <PCAT_CMPD_ID> (2,528)
WAY-329020

>  <CNC_ID> (2,528)
359316385

>  <transfer_container_id> (2,528)
PTN000000065

>  <COMPOUND_NUMBER> (2,528)
WAY-329020

>  <BAR_CODE_NO> (2,528)
304021

>  <LOCATION_CODE> (2,528)
PTNCS

>  <AMOUNT_CURRENT> (2,528)
32.5

$$$$
WAY-329036
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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  9  6  1  0  0  0  0
 10  5  1  0  0  0  0
 11  6  2  0  0  0  0
 12  3  2  0  0  0  0
 13  5  2  0  0  0  0
 14  9  2  0  0  0  0
 15 11  1  0  0  0  0
 16  7  1  0  0  0  0
 17  2  1  0  0  0  0
 18 15  2  0  0  0  0
 19  9  1  0  0  0  0
 20 15  1  0  0  0  0
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 25 24  1  0  0  0  0
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 28 25  1  0  0  0  0
 10  8  1  0  0  0  0
 18 14  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,529)
2529

>  <Formula> (2,529)
C22H32N2O4

>  <MolWeight> (2,529)
388.50048

>  <PCAT_CMPD_ID> (2,529)
WAY-329036

>  <CNC_ID> (2,529)
359316401

>  <transfer_container_id> (2,529)
PTN000000065

>  <COMPOUND_NUMBER> (2,529)
WAY-329036

>  <BAR_CODE_NO> (2,529)
304037

>  <LOCATION_CODE> (2,529)
PTNCS

>  <AMOUNT_CURRENT> (2,529)
32.5

$$$$
WAY-334011
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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  5 11  1  0  0  0  0
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 10  5  2  0  0  0  0
 11 14  1  0  0  0  0
 12  4  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16  7  1  0  0  0  0
 17 16  2  0  0  0  0
 18  8  2  0  0  0  0
 19  8  1  0  0  0  0
 20 17  1  0  0  0  0
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 22 19  2  0  0  0  0
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 24 22  1  0  0  0  0
  6  3  1  0  0  0  0
 24 23  2  0  0  0  0
 20 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,530)
2530

>  <Formula> (2,530)
C19H18N2O2S

>  <MolWeight> (2,530)
338.42342

>  <PCAT_CMPD_ID> (2,530)
WAY-334011

>  <CNC_ID> (2,530)
359332544

>  <transfer_container_id> (2,530)
PTN000000067

>  <COMPOUND_NUMBER> (2,530)
WAY-334011

>  <BAR_CODE_NO> (2,530)
309012

>  <LOCATION_CODE> (2,530)
PTNCS

>  <AMOUNT_CURRENT> (2,530)
32.5

$$$$
WAY-332616
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  2  0  0  0  0
 14  9  2  0  0  0  0
 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 11  1  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
 21 18  1  0  0  0  0
  5  3  1  0  0  0  0
 10  7  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,531)
2531

>  <Formula> (2,531)
C16H15NO3S

>  <MolWeight> (2,531)
301.3602

>  <PCAT_CMPD_ID> (2,531)
WAY-332616

>  <CNC_ID> (2,531)
359331152

>  <transfer_container_id> (2,531)
PTN000000067

>  <COMPOUND_NUMBER> (2,531)
WAY-332616

>  <BAR_CODE_NO> (2,531)
307617

>  <LOCATION_CODE> (2,531)
PTNCS

>  <AMOUNT_CURRENT> (2,531)
32.5

$$$$
WAY-332647
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  4  2  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12  7  2  0  0  0  0
 13  5  2  0  0  0  0
 14  9  2  0  0  0  0
 15 10  2  0  0  0  0
 16 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 11  1  0  0  0  0
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 23 21  1  0  0  0  0
 24 22  1  0  0  0  0
  3  4  1  0  0  0  0
 10  7  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,532)
2532

>  <Formula> (2,532)
C19H21NO3S

>  <MolWeight> (2,532)
343.43994

>  <PCAT_CMPD_ID> (2,532)
WAY-332647

>  <CNC_ID> (2,532)
359331183

>  <transfer_container_id> (2,532)
PTN000000067

>  <COMPOUND_NUMBER> (2,532)
WAY-332647

>  <BAR_CODE_NO> (2,532)
307648

>  <LOCATION_CODE> (2,532)
PTNCS

>  <AMOUNT_CURRENT> (2,532)
32.5

$$$$
WAY-332651
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  5  2  0  0  0  0
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 15 10  1  0  0  0  0
 16  8  2  0  0  0  0
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 11  7  1  0  0  0  0
 19 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,533)
2533

>  <Formula> (2,533)
C21H25NO3S

>  <MolWeight> (2,533)
371.4931

>  <PCAT_CMPD_ID> (2,533)
WAY-332651

>  <CNC_ID> (2,533)
359331187

>  <transfer_container_id> (2,533)
PTN000000067

>  <COMPOUND_NUMBER> (2,533)
WAY-332651

>  <BAR_CODE_NO> (2,533)
307652

>  <LOCATION_CODE> (2,533)
PTNCS

>  <AMOUNT_CURRENT> (2,533)
32.5

$$$$
WAY-643422
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11 15  1  0  0  0  0
 12  9  2  0  0  0  0
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 14  7  2  0  0  0  0
 15 13  1  0  0  0  0
 16 11  2  0  0  0  0
 17  9  1  0  0  0  0
 18  8  1  0  0  0  0
 19 10  1  0  0  0  0
 20 12  1  0  0  0  0
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 22 21  1  0  0  0  0
  5  3  1  0  0  0  0
 12  6  1  0  0  0  0
 22 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,534)
2534

>  <Formula> (2,534)
C16H14N2O4

>  <MolWeight> (2,534)
298.29336

>  <PCAT_CMPD_ID> (2,534)
WAY-643422

>  <CNC_ID> (2,534)
359325160

>  <transfer_container_id> (2,534)
PTN000000065

>  <COMPOUND_NUMBER> (2,534)
WAY-643422

>  <BAR_CODE_NO> (2,534)
90477994

>  <LOCATION_CODE> (2,534)
PTNCS

>  <AMOUNT_CURRENT> (2,534)
32.5

$$$$
WAY-624529
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 30  8  1  0  0  0  0
 19 23  1  0  0  0  0
 20  2  1  0  0  0  0
 21 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,535)
2535

>  <Formula> (2,535)
C21H24ClN3O4S

>  <MolWeight> (2,535)
449.95096

>  <PCAT_CMPD_ID> (2,535)
WAY-624529

>  <CNC_ID> (2,535)
359322950

>  <transfer_container_id> (2,535)
PTN000000065

>  <COMPOUND_NUMBER> (2,535)
WAY-624529

>  <BAR_CODE_NO> (2,535)
90458705

>  <LOCATION_CODE> (2,535)
PTNCS

>  <AMOUNT_CURRENT> (2,535)
32.8

$$$$
WAY-331628
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 20  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,536)
2536

>  <Formula> (2,536)
C25H30N4O4S

>  <MolWeight> (2,536)
482.5951

>  <PCAT_CMPD_ID> (2,536)
WAY-331628

>  <CNC_ID> (2,536)
359330166

>  <transfer_container_id> (2,536)
PTN000000067

>  <COMPOUND_NUMBER> (2,536)
WAY-331628

>  <BAR_CODE_NO> (2,536)
306629

>  <LOCATION_CODE> (2,536)
PTNCS

>  <AMOUNT_CURRENT> (2,536)
32.5

$$$$
WAY-329914
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  7  2  0  0  0  0
  5  2  2  0  0  0  0
  6  5  1  0  0  0  0
  7  2  1  0  0  0  0
  8 12  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12 16  1  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
 15  8  2  0  0  0  0
 16 14  1  0  0  0  0
 17 13  1  0  0  0  0
 18  9  1  0  0  0  0
 19 22  2  0  0  0  0
 20 18  1  0  0  0  0
 21 18  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24  5  1  0  0  0  0
 25  7  1  0  0  0  0
 26 19  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 17 12  1  0  0  0  0
  4  6  1  0  0  0  0
 19 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,537)
2537

>  <Formula> (2,537)
C19H26N4O4S

>  <MolWeight> (2,537)
406.49914

>  <PCAT_CMPD_ID> (2,537)
WAY-329914

>  <CNC_ID> (2,537)
359317280

>  <transfer_container_id> (2,537)
PTN000000065

>  <COMPOUND_NUMBER> (2,537)
WAY-329914

>  <BAR_CODE_NO> (2,537)
304915

>  <LOCATION_CODE> (2,537)
PTNCS

>  <AMOUNT_CURRENT> (2,537)
32.5

$$$$
WAY-643861
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    0.3292   -0.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6 10  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  1  0  0  0  0
 11  2  2  0  0  0  0
 12  4  1  0  0  0  0
 13  8  2  0  0  0  0
 14  9  2  0  0  0  0
 15  3  1  0  0  0  0
 16  5  1  0  0  0  0
 17  6  1  0  0  0  0
 18 17  1  0  0  0  0
 19  9  1  0  0  0  0
 20 18  1  0  0  0  0
 21 12  1  0  0  0  0
 22 12  2  0  0  0  0
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 24 19  2  0  0  0  0
 25 24  1  0  0  0  0
 26 22  1  0  0  0  0
 27 21  2  0  0  0  0
 28 26  2  0  0  0  0
  3  4  1  0  0  0  0
 28 27  1  0  0  0  0
 20 14  1  0  0  0  0
 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,538)
2538

>  <Formula> (2,538)
C22H24N4O2

>  <MolWeight> (2,538)
376.45156

>  <PCAT_CMPD_ID> (2,538)
WAY-643861

>  <CNC_ID> (2,538)
359325600

>  <transfer_container_id> (2,538)
PTN000000065

>  <COMPOUND_NUMBER> (2,538)
WAY-643861

>  <BAR_CODE_NO> (2,538)
90478434

>  <LOCATION_CODE> (2,538)
PTNCS

>  <AMOUNT_CURRENT> (2,538)
32.2

$$$$
WAY-641834
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  2  1  0  0  0  0
  5  1  2  0  0  0  0
  6 11  1  0  0  0  0
  7  6  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  7  1  0  0  0  0
 11 14  1  0  0  0  0
 12  1  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15  2  2  0  0  0  0
 16  4  1  0  0  0  0
 17  7  2  0  0  0  0
 18  9  2  0  0  0  0
 19 14  2  0  0  0  0
 20  3  1  0  0  0  0
 21  5  1  0  0  0  0
 22 10  1  0  0  0  0
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 24 16  1  0  0  0  0
 25 16  2  0  0  0  0
 26 22  2  0  0  0  0
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 28 25  1  0  0  0  0
 29 24  2  0  0  0  0
 30 28  2  0  0  0  0
  3  4  1  0  0  0  0
 30 29  1  0  0  0  0
 13 10  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,539)
2539

>  <Formula> (2,539)
C21H19N5O4

>  <MolWeight> (2,539)
405.40666

>  <PCAT_CMPD_ID> (2,539)
WAY-641834

>  <CNC_ID> (2,539)
359323572

>  <transfer_container_id> (2,539)
PTN000000065

>  <COMPOUND_NUMBER> (2,539)
WAY-641834

>  <BAR_CODE_NO> (2,539)
90476387

>  <LOCATION_CODE> (2,539)
PTNCS

>  <AMOUNT_CURRENT> (2,539)
32.5

$$$$
WAY-643343
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  1  0  0  0  0
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 10  1  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
 13  4  1  0  0  0  0
 14  8  2  0  0  0  0
 15 13  1  0  0  0  0
 16  2  2  0  0  0  0
 17  3  2  0  0  0  0
 18 11  2  0  0  0  0
 19 15  2  0  0  0  0
 20  4  1  0  0  0  0
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  5  4  1  0  0  0  0
 12 14  1  0  0  0  0
 27 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,540)
2540

>  <Formula> (2,540)
C18H20N4O5

>  <MolWeight> (2,540)
372.3752

>  <PCAT_CMPD_ID> (2,540)
WAY-643343

>  <CNC_ID> (2,540)
359325081

>  <transfer_container_id> (2,540)
PTN000000065

>  <COMPOUND_NUMBER> (2,540)
WAY-643343

>  <BAR_CODE_NO> (2,540)
90477914

>  <LOCATION_CODE> (2,540)
PTNCS

>  <AMOUNT_CURRENT> (2,540)
32.8

$$$$
WAY-624708
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  1  0  0  0  0
 13  8  2  0  0  0  0
 14  2  2  0  0  0  0
 15  3  2  0  0  0  0
 16  5  1  0  0  0  0
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 18  5  1  0  0  0  0
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  5  4  1  0  0  0  0
 12 13  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,541)
2541

>  <Formula> (2,541)
C16H16N4O4

>  <MolWeight> (2,541)
328.32264

>  <PCAT_CMPD_ID> (2,541)
WAY-624708

>  <CNC_ID> (2,541)
359323129

>  <transfer_container_id> (2,541)
PTN000000065

>  <COMPOUND_NUMBER> (2,541)
WAY-624708

>  <BAR_CODE_NO> (2,541)
90458884

>  <LOCATION_CODE> (2,541)
PTNCS

>  <AMOUNT_CURRENT> (2,541)
32.9

$$$$
WAY-278629
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 11  6  2  0  0  0  0
 12  2  1  0  0  0  0
 13  5  1  0  0  0  0
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 15  9  2  0  0  0  0
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 17 10  1  0  0  0  0
 18 13  2  0  0  0  0
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 23 19  2  0  0  0  0
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 25 23  1  0  0  0  0
  4 10  2  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,542)
2542

>  <Formula> (2,542)
C21H17N3O

>  <MolWeight> (2,542)
327.37918

>  <PCAT_CMPD_ID> (2,542)
WAY-278629

>  <CNC_ID> (2,542)
359327349

>  <transfer_container_id> (2,542)
PTN000000067

>  <COMPOUND_NUMBER> (2,542)
WAY-278629

>  <BAR_CODE_NO> (2,542)
389284

>  <LOCATION_CODE> (2,542)
PTNCS

>  <AMOUNT_CURRENT> (2,542)
32.5

$$$$
WAY-344011
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11 12  1  0  0  0  0
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 13  7  2  0  0  0  0
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 15  8  1  0  0  0  0
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 18  5  1  0  0  0  0
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 24  4  2  0  0  0  0
 25  6  2  0  0  0  0
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 28 11  1  0  0  0  0
 29 24  1  0  0  0  0
 30 29  2  0  0  0  0
  3  5  2  0  0  0  0
 25 30  1  0  0  0  0
 12 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,543)
2543

>  <Formula> (2,543)
C23H25N3O4

>  <MolWeight> (2,543)
407.4623

>  <PCAT_CMPD_ID> (2,543)
WAY-344011

>  <CNC_ID> (2,543)
359319349

>  <transfer_container_id> (2,543)
PTN000000074

>  <COMPOUND_NUMBER> (2,543)
WAY-344011

>  <BAR_CODE_NO> (2,543)
90454927

>  <LOCATION_CODE> (2,543)
PTNCS

>  <AMOUNT_CURRENT> (2,543)
32.1

$$$$
WAY-616175
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 12  7  1  0  0  0  0
 13  8  2  0  0  0  0
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 15  5  1  0  0  0  0
 16  5  1  0  0  0  0
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 22  3  1  0  0  0  0
 23  6  1  0  0  0  0
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 25 24  1  0  0  0  0
 10  6  1  0  0  0  0
 23 25  2  0  0  0  0
 19 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,544)
2544

>  <Formula> (2,544)
C18H16F2N2O3

>  <MolWeight> (2,544)
346.3280464

>  <PCAT_CMPD_ID> (2,544)
WAY-616175

>  <CNC_ID> (2,544)
359321260

>  <transfer_container_id> (2,544)
PTN000000065

>  <COMPOUND_NUMBER> (2,544)
WAY-616175

>  <BAR_CODE_NO> (2,544)
90450155

>  <LOCATION_CODE> (2,544)
PTNCS

>  <AMOUNT_CURRENT> (2,544)
32.2

$$$$
WAY-332376
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 23 24  2  0  0  0  0
 19 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,545)
2545

>  <Formula> (2,545)
C17H16ClN5O

>  <MolWeight> (2,545)
341.79484

>  <PCAT_CMPD_ID> (2,545)
WAY-332376

>  <CNC_ID> (2,545)
359330912

>  <transfer_container_id> (2,545)
PTN000000067

>  <COMPOUND_NUMBER> (2,545)
WAY-332376

>  <BAR_CODE_NO> (2,545)
307377

>  <LOCATION_CODE> (2,545)
PTNCS

>  <AMOUNT_CURRENT> (2,545)
32.5

$$$$
WAY-642541
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 15  3  1  0  0  0  0
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M  END
>  <Mol_ID> (2,546)
2546

>  <Formula> (2,546)
C22H21NO4

>  <MolWeight> (2,546)
363.40644

>  <PCAT_CMPD_ID> (2,546)
WAY-642541

>  <CNC_ID> (2,546)
359324279

>  <transfer_container_id> (2,546)
PTN000000065

>  <COMPOUND_NUMBER> (2,546)
WAY-642541

>  <BAR_CODE_NO> (2,546)
90477102

>  <LOCATION_CODE> (2,546)
PTNCS

>  <AMOUNT_CURRENT> (2,546)
32.8

$$$$
WAY-642943
csChFnd80/10111816222D

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 13  9  2  0  0  0  0
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 16  4  1  0  0  0  0
 17  9  1  0  0  0  0
 18  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,547)
2547

>  <Formula> (2,547)
C13H14N2O4S

>  <MolWeight> (2,547)
294.32626

>  <PCAT_CMPD_ID> (2,547)
WAY-642943

>  <CNC_ID> (2,547)
359324681

>  <transfer_container_id> (2,547)
PTN000000065

>  <COMPOUND_NUMBER> (2,547)
WAY-642943

>  <BAR_CODE_NO> (2,547)
90477509

>  <LOCATION_CODE> (2,547)
PTNCS

>  <AMOUNT_CURRENT> (2,547)
32.9

$$$$
WAY-642295
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 15  2  1  0  0  0  0
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M  END
>  <Mol_ID> (2,548)
2548

>  <Formula> (2,548)
C20H22N4O4S

>  <MolWeight> (2,548)
414.47808

>  <PCAT_CMPD_ID> (2,548)
WAY-642295

>  <CNC_ID> (2,548)
359324033

>  <transfer_container_id> (2,548)
PTN000000065

>  <COMPOUND_NUMBER> (2,548)
WAY-642295

>  <BAR_CODE_NO> (2,548)
90476854

>  <LOCATION_CODE> (2,548)
PTNCS

>  <AMOUNT_CURRENT> (2,548)
32.5

$$$$
WAY-278476
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,549)
2549

>  <Formula> (2,549)
C14H8ClNO3

>  <MolWeight> (2,549)
273.67122

>  <PCAT_CMPD_ID> (2,549)
WAY-278476

>  <CNC_ID> (2,549)
359327196

>  <transfer_container_id> (2,549)
PTN000000067

>  <COMPOUND_NUMBER> (2,549)
WAY-278476

>  <BAR_CODE_NO> (2,549)
389130

>  <LOCATION_CODE> (2,549)
PTNCS

>  <AMOUNT_CURRENT> (2,549)
32.5

$$$$
WAY-624056
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,550)
2550

>  <Formula> (2,550)
C24H27N5O5S

>  <MolWeight> (2,550)
497.56668

>  <PCAT_CMPD_ID> (2,550)
WAY-624056

>  <CNC_ID> (2,550)
359322676

>  <transfer_container_id> (2,550)
PTN000000065

>  <COMPOUND_NUMBER> (2,550)
WAY-624056

>  <BAR_CODE_NO> (2,550)
90458230

>  <LOCATION_CODE> (2,550)
PTNCS

>  <AMOUNT_CURRENT> (2,550)
33

$$$$
WAY-643902
csChFnd80/10111816222D

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 12 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,551)
2551

>  <Formula> (2,551)
C17H15NO5

>  <MolWeight> (2,551)
313.3047

>  <PCAT_CMPD_ID> (2,551)
WAY-643902

>  <CNC_ID> (2,551)
359325641

>  <transfer_container_id> (2,551)
PTN000000065

>  <COMPOUND_NUMBER> (2,551)
WAY-643902

>  <BAR_CODE_NO> (2,551)
90478476

>  <LOCATION_CODE> (2,551)
PTNCS

>  <AMOUNT_CURRENT> (2,551)
32.4

$$$$
WAY-624115
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 11  7  1  0  0  0  0
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M  END
>  <Mol_ID> (2,552)
2552

>  <Formula> (2,552)
C19H20N4O4

>  <MolWeight> (2,552)
368.3865

>  <PCAT_CMPD_ID> (2,552)
WAY-624115

>  <CNC_ID> (2,552)
359322734

>  <transfer_container_id> (2,552)
PTN000000065

>  <COMPOUND_NUMBER> (2,552)
WAY-624115

>  <BAR_CODE_NO> (2,552)
90458289

>  <LOCATION_CODE> (2,552)
PTNCS

>  <AMOUNT_CURRENT> (2,552)
32.8

$$$$
WAY-616133
csChFnd80/10111816222D

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 15  7  2  0  0  0  0
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 19 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,553)
2553

>  <Formula> (2,553)
C18H26N2O6

>  <MolWeight> (2,553)
366.40884

>  <PCAT_CMPD_ID> (2,553)
WAY-616133

>  <CNC_ID> (2,553)
359321218

>  <transfer_container_id> (2,553)
PTN000000065

>  <COMPOUND_NUMBER> (2,553)
WAY-616133

>  <BAR_CODE_NO> (2,553)
90450113

>  <LOCATION_CODE> (2,553)
PTNCS

>  <AMOUNT_CURRENT> (2,553)
32.5

$$$$
WAY-278678
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,554)
2554

>  <Formula> (2,554)
C20H16N4O3S

>  <MolWeight> (2,554)
392.43104

>  <PCAT_CMPD_ID> (2,554)
WAY-278678

>  <CNC_ID> (2,554)
359327398

>  <transfer_container_id> (2,554)
PTN000000067

>  <COMPOUND_NUMBER> (2,554)
WAY-278678

>  <BAR_CODE_NO> (2,554)
389333

>  <LOCATION_CODE> (2,554)
PTNCS

>  <AMOUNT_CURRENT> (2,554)
32.5

$$$$
WAY-329487
csChFnd80/10111816222D

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 13  6  2  0  0  0  0
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  9  8  1  0  0  0  0
  5  2  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,555)
2555

>  <Formula> (2,555)
C19H23NO4

>  <MolWeight> (2,555)
329.39022

>  <PCAT_CMPD_ID> (2,555)
WAY-329487

>  <CNC_ID> (2,555)
359316855

>  <transfer_container_id> (2,555)
PTN000000065

>  <COMPOUND_NUMBER> (2,555)
WAY-329487

>  <BAR_CODE_NO> (2,555)
304488

>  <LOCATION_CODE> (2,555)
PTNCS

>  <AMOUNT_CURRENT> (2,555)
32.5

$$$$
WAY-333159
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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 14  5  2  0  0  0  0
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  9  8  1  0  0  0  0
  7  6  1  0  0  0  0
 10 18  1  0  0  0  0
 34 32  2  0  0  0  0
 25 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,556)
2556

>  <Formula> (2,556)
C25H27FN6O2

>  <MolWeight> (2,556)
462.5192832

>  <PCAT_CMPD_ID> (2,556)
WAY-333159

>  <CNC_ID> (2,556)
359331694

>  <transfer_container_id> (2,556)
PTN000000067

>  <COMPOUND_NUMBER> (2,556)
WAY-333159

>  <BAR_CODE_NO> (2,556)
308160

>  <LOCATION_CODE> (2,556)
PTNCS

>  <AMOUNT_CURRENT> (2,556)
32.5

$$$$
WAY-333157
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
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 11  9  1  0  0  0  0
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 16  5  2  0  0  0  0
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 20  4  1  0  0  0  0
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  9  8  1  0  0  0  0
  7  6  1  0  0  0  0
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 34 32  2  0  0  0  0
 29 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,557)
2557

>  <Formula> (2,557)
C25H27ClN6O2

>  <MolWeight> (2,557)
478.97388

>  <PCAT_CMPD_ID> (2,557)
WAY-333157

>  <CNC_ID> (2,557)
359331692

>  <transfer_container_id> (2,557)
PTN000000067

>  <COMPOUND_NUMBER> (2,557)
WAY-333157

>  <BAR_CODE_NO> (2,557)
308158

>  <LOCATION_CODE> (2,557)
PTNCS

>  <AMOUNT_CURRENT> (2,557)
32.5

$$$$
WAY-331259
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  5  2  0  0  0  0
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 15 10  1  0  0  0  0
 16  3  1  0  0  0  0
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  8  9  1  0  0  0  0
  4  6  1  0  0  0  0
 26 22  1  0  0  0  0
 29 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,558)
2558

>  <Formula> (2,558)
C22H29N5O2

>  <MolWeight> (2,558)
395.49796

>  <PCAT_CMPD_ID> (2,558)
WAY-331259

>  <CNC_ID> (2,558)
359318614

>  <transfer_container_id> (2,558)
PTN000000065

>  <COMPOUND_NUMBER> (2,558)
WAY-331259

>  <BAR_CODE_NO> (2,558)
306260

>  <LOCATION_CODE> (2,558)
PTNCS

>  <AMOUNT_CURRENT> (2,558)
32.5

$$$$
WAY-332941
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,559)
2559

>  <Formula> (2,559)
C19H13ClN4O

>  <MolWeight> (2,559)
348.78572

>  <PCAT_CMPD_ID> (2,559)
WAY-332941

>  <CNC_ID> (2,559)
359331476

>  <transfer_container_id> (2,559)
PTN000000067

>  <COMPOUND_NUMBER> (2,559)
WAY-332941

>  <BAR_CODE_NO> (2,559)
307942

>  <LOCATION_CODE> (2,559)
PTNCS

>  <AMOUNT_CURRENT> (2,559)
32.5

$$$$
WAY-643485
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 17  3  1  0  0  0  0
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 21  6  2  0  0  0  0
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 15  8  2  0  0  0  0
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M  END
>  <Mol_ID> (2,560)
2560

>  <Formula> (2,560)
C21H26N4O6S

>  <MolWeight> (2,560)
462.51934

>  <PCAT_CMPD_ID> (2,560)
WAY-643485

>  <CNC_ID> (2,560)
359325223

>  <transfer_container_id> (2,560)
PTN000000065

>  <COMPOUND_NUMBER> (2,560)
WAY-643485

>  <BAR_CODE_NO> (2,560)
90478057

>  <LOCATION_CODE> (2,560)
PTNCS

>  <AMOUNT_CURRENT> (2,560)
32.3

$$$$
WAY-332765
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    6.9889    9.6517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  8  1  0  0  0  0
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 15  5  1  0  0  0  0
 27 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,561)
2561

>  <Formula> (2,561)
C23H27N3O3S

>  <MolWeight> (2,561)
425.54378

>  <PCAT_CMPD_ID> (2,561)
WAY-332765

>  <CNC_ID> (2,561)
359331301

>  <transfer_container_id> (2,561)
PTN000000067

>  <COMPOUND_NUMBER> (2,561)
WAY-332765

>  <BAR_CODE_NO> (2,561)
307766

>  <LOCATION_CODE> (2,561)
PTNCS

>  <AMOUNT_CURRENT> (2,561)
32.5

$$$$
WAY-333018
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
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  5  4  2  0  0  0  0
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 26 24  2  0  0  0  0
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M  END
>  <Mol_ID> (2,562)
2562

>  <Formula> (2,562)
C17H13FN6O3

>  <MolWeight> (2,562)
368.3219232

>  <PCAT_CMPD_ID> (2,562)
WAY-333018

>  <CNC_ID> (2,562)
359331553

>  <transfer_container_id> (2,562)
PTN000000067

>  <COMPOUND_NUMBER> (2,562)
WAY-333018

>  <BAR_CODE_NO> (2,562)
308019

>  <LOCATION_CODE> (2,562)
PTNCS

>  <AMOUNT_CURRENT> (2,562)
32.5

$$$$
CL-260433
csChFnd80/10111816222D

 11 12  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (2,563)
2563

>  <Formula> (2,563)
C6H5ClN4

>  <MolWeight> (2,563)
168.5837

>  <PCAT_CMPD_ID> (2,563)
CL-260433

>  <CNC_ID> (2,563)
359326698

>  <transfer_container_id> (2,563)
PTN000000067

>  <COMPOUND_NUMBER> (2,563)
CL-260433

>  <BAR_CODE_NO> (2,563)
90479416

>  <LOCATION_CODE> (2,563)
PTNCS

>  <AMOUNT_CURRENT> (2,563)
32.7

$$$$
WAY-329107
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 14  6  2  0  0  0  0
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M  END
>  <Mol_ID> (2,564)
2564

>  <Formula> (2,564)
C21H23N3O3S

>  <MolWeight> (2,564)
397.49062

>  <PCAT_CMPD_ID> (2,564)
WAY-329107

>  <CNC_ID> (2,564)
359316472

>  <transfer_container_id> (2,564)
PTN000000065

>  <COMPOUND_NUMBER> (2,564)
WAY-329107

>  <BAR_CODE_NO> (2,564)
304108

>  <LOCATION_CODE> (2,564)
PTNCS

>  <AMOUNT_CURRENT> (2,564)
32.5

$$$$
WAY-616889
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 11  3  2  0  0  0  0
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 13 10  2  0  0  0  0
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 15  9  1  0  0  0  0
 16  6  1  0  0  0  0
 17  8  1  0  0  0  0
 18 12  1  0  0  0  0
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 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,565)
2565

>  <Formula> (2,565)
C15H19N3O2S

>  <MolWeight> (2,565)
305.39526

>  <PCAT_CMPD_ID> (2,565)
WAY-616889

>  <CNC_ID> (2,565)
359321975

>  <transfer_container_id> (2,565)
PTN000000065

>  <COMPOUND_NUMBER> (2,565)
WAY-616889

>  <BAR_CODE_NO> (2,565)
90450888

>  <LOCATION_CODE> (2,565)
PTNCS

>  <AMOUNT_CURRENT> (2,565)
32.5

$$$$
WAY-329119
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 13  5  2  0  0  0  0
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 22  8  1  0  0  0  0
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  3  6  1  0  0  0  0
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 16 18  2  0  0  0  0
 32 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,566)
2566

>  <Formula> (2,566)
C24H29N3O4S

>  <MolWeight> (2,566)
455.56976

>  <PCAT_CMPD_ID> (2,566)
WAY-329119

>  <CNC_ID> (2,566)
359316484

>  <transfer_container_id> (2,566)
PTN000000065

>  <COMPOUND_NUMBER> (2,566)
WAY-329119

>  <BAR_CODE_NO> (2,566)
304120

>  <LOCATION_CODE> (2,566)
PTNCS

>  <AMOUNT_CURRENT> (2,566)
32.5

$$$$
WAY-331203
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 13  8  1  0  0  0  0
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 15  5  2  0  0  0  0
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  9  8  1  0  0  0  0
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 11 21  1  0  0  0  0
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M  END
>  <Mol_ID> (2,567)
2567

>  <Formula> (2,567)
C19H24N6O4

>  <MolWeight> (2,567)
400.43166

>  <PCAT_CMPD_ID> (2,567)
WAY-331203

>  <CNC_ID> (2,567)
359318558

>  <transfer_container_id> (2,567)
PTN000000065

>  <COMPOUND_NUMBER> (2,567)
WAY-331203

>  <BAR_CODE_NO> (2,567)
306204

>  <LOCATION_CODE> (2,567)
PTNCS

>  <AMOUNT_CURRENT> (2,567)
32.5

$$$$
WAY-331205
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 13  8  1  0  0  0  0
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 15  5  2  0  0  0  0
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 23 19  1  0  0  0  0
 24  3  1  0  0  0  0
 25  4  1  0  0  0  0
 26 14  1  0  0  0  0
 27 14  1  0  0  0  0
 28  9  1  0  0  0  0
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 30 29  1  0  0  0  0
  9  8  1  0  0  0  0
  4  6  1  0  0  0  0
 11 21  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,568)
2568

>  <Formula> (2,568)
C20H26N6O4

>  <MolWeight> (2,568)
414.45824

>  <PCAT_CMPD_ID> (2,568)
WAY-331205

>  <CNC_ID> (2,568)
359318560

>  <transfer_container_id> (2,568)
PTN000000065

>  <COMPOUND_NUMBER> (2,568)
WAY-331205

>  <BAR_CODE_NO> (2,568)
306206

>  <LOCATION_CODE> (2,568)
PTNCS

>  <AMOUNT_CURRENT> (2,568)
32.5

$$$$
WAY-331207
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   -6.9208    4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9375    7.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9708    3.7958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0042    7.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0042    4.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
 11 20  1  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14 13  1  0  0  0  0
 15  5  2  0  0  0  0
 16  6  2  0  0  0  0
 17 12  1  0  0  0  0
 18 10  2  0  0  0  0
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 20 27  1  0  0  0  0
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 22 17  1  0  0  0  0
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 24  3  1  0  0  0  0
 25  4  1  0  0  0  0
 26 14  1  0  0  0  0
 27 14  1  0  0  0  0
 28  9  1  0  0  0  0
 29 28  1  0  0  0  0
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 31 30  1  0  0  0  0
  9  8  1  0  0  0  0
  4  6  1  0  0  0  0
 11 21  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,569)
2569

>  <Formula> (2,569)
C21H28N6O4

>  <MolWeight> (2,569)
428.48482

>  <PCAT_CMPD_ID> (2,569)
WAY-331207

>  <CNC_ID> (2,569)
359318562

>  <transfer_container_id> (2,569)
PTN000000065

>  <COMPOUND_NUMBER> (2,569)
WAY-331207

>  <BAR_CODE_NO> (2,569)
306208

>  <LOCATION_CODE> (2,569)
PTNCS

>  <AMOUNT_CURRENT> (2,569)
32.5

$$$$
WAY-331208
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
   -6.9375    7.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9208    4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9708    3.7958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0042    7.3167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7167    8.0667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0042    4.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9708    8.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -13.0542    8.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.5708   12.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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 13  9  1  0  0  0  0
 14 13  1  0  0  0  0
 15  5  1  0  0  0  0
 16  6  2  0  0  0  0
 17  7  2  0  0  0  0
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 19 10  2  0  0  0  0
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 25  3  1  0  0  0  0
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  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 34 32  2  0  0  0  0
 11 22  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,570)
2570

>  <Formula> (2,570)
C24H26N6O4

>  <MolWeight> (2,570)
462.50104

>  <PCAT_CMPD_ID> (2,570)
WAY-331208

>  <CNC_ID> (2,570)
359318563

>  <transfer_container_id> (2,570)
PTN000000065

>  <COMPOUND_NUMBER> (2,570)
WAY-331208

>  <BAR_CODE_NO> (2,570)
306209

>  <LOCATION_CODE> (2,570)
PTNCS

>  <AMOUNT_CURRENT> (2,570)
32.5

$$$$
WAY-331211
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
   -6.9375    7.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9208    4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14  9  1  0  0  0  0
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 26  3  1  0  0  0  0
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  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 35 33  2  0  0  0  0
 12 23  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,571)
2571

>  <Formula> (2,571)
C25H28N6O4

>  <MolWeight> (2,571)
476.52762

>  <PCAT_CMPD_ID> (2,571)
WAY-331211

>  <CNC_ID> (2,571)
359318566

>  <transfer_container_id> (2,571)
PTN000000065

>  <COMPOUND_NUMBER> (2,571)
WAY-331211

>  <BAR_CODE_NO> (2,571)
306212

>  <LOCATION_CODE> (2,571)
PTNCS

>  <AMOUNT_CURRENT> (2,571)
32.5

$$$$
WAY-642585-A
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
    3.7375    0.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5167   -0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12  8  1  0  0  0  0
 13  7  2  0  0  0  0
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 15 10  1  0  0  0  0
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 14 12  2  0  0  0  0
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M  END
>  <Mol_ID> (2,572)
2572

>  <Formula> (2,572)
C16H12N4S

>  <MolWeight> (2,572)
292.35828

>  <PCAT_CMPD_ID> (2,572)
WAY-642585-A

>  <CNC_ID> (2,572)
359324323

>  <transfer_container_id> (2,572)
PTN000000065

>  <COMPOUND_NUMBER> (2,572)
WAY-642585-A

>  <BAR_CODE_NO> (2,572)
90477146

>  <LOCATION_CODE> (2,572)
PTNCS

>  <AMOUNT_CURRENT> (2,572)
32.5

$$$$
WAY-624704
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  5  1  1  0  0  0  0
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 10 20  2  0  0  0  0
 11  7  1  0  0  0  0
 12 11  1  0  0  0  0
 13 17  2  0  0  0  0
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 15 12  2  0  0  0  0
 16 14  2  0  0  0  0
 17 15  1  0  0  0  0
 18 13  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21  8  1  0  0  0  0
 22  8  2  0  0  0  0
 23 18  1  0  0  0  0
  6  3  2  0  0  0  0
 10 19  1  0  0  0  0
 16 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,573)
2573

>  <Formula> (2,573)
C17H15N3O2S

>  <MolWeight> (2,573)
325.3849

>  <PCAT_CMPD_ID> (2,573)
WAY-624704

>  <CNC_ID> (2,573)
359323125

>  <transfer_container_id> (2,573)
PTN000000065

>  <COMPOUND_NUMBER> (2,573)
WAY-624704

>  <BAR_CODE_NO> (2,573)
90458880

>  <LOCATION_CODE> (2,573)
PTNCS

>  <AMOUNT_CURRENT> (2,573)
32.4

$$$$
WAY-624921
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  4  1  0  0  0  0
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 13 10  1  0  0  0  0
 14  8  1  0  0  0  0
 15  9  2  0  0  0  0
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 17  5  1  0  0  0  0
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 27 22  1  0  0  0  0
 28 19  1  0  0  0  0
 29 25  1  0  0  0  0
 30 27  2  0  0  0  0
  5  7  2  0  0  0  0
  8 13  1  0  0  0  0
 23 24  1  0  0  0  0
 30 26  1  0  0  0  0
 29 28  2  0  0  0  0
M  END
>  <Mol_ID> (2,574)
2574

>  <Formula> (2,574)
C25H24N4O

>  <MolWeight> (2,574)
396.48426

>  <PCAT_CMPD_ID> (2,574)
WAY-624921

>  <CNC_ID> (2,574)
359323342

>  <transfer_container_id> (2,574)
PTN000000065

>  <COMPOUND_NUMBER> (2,574)
WAY-624921

>  <BAR_CODE_NO> (2,574)
90459101

>  <LOCATION_CODE> (2,574)
PTNCS

>  <AMOUNT_CURRENT> (2,574)
32.4

$$$$
WAY-623556
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  8  1  0  0  0  0
 12  9  1  0  0  0  0
 13  3  1  0  0  0  0
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 23 20  1  0  0  0  0
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  7  4  1  0  0  0  0
 11 10  2  0  0  0  0
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 15 16  2  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,575)
2575

>  <Formula> (2,575)
C20H14N4O

>  <MolWeight> (2,575)
326.35136

>  <PCAT_CMPD_ID> (2,575)
WAY-623556

>  <CNC_ID> (2,575)
359322176

>  <transfer_container_id> (2,575)
PTN000000065

>  <COMPOUND_NUMBER> (2,575)
WAY-623556

>  <BAR_CODE_NO> (2,575)
90457725

>  <LOCATION_CODE> (2,575)
PTNCS

>  <AMOUNT_CURRENT> (2,575)
32.9

$$$$
WAY-641885
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,576)
2576

>  <Formula> (2,576)
C17H17N3O2

>  <MolWeight> (2,576)
295.33578

>  <PCAT_CMPD_ID> (2,576)
WAY-641885

>  <CNC_ID> (2,576)
359323623

>  <transfer_container_id> (2,576)
PTN000000065

>  <COMPOUND_NUMBER> (2,576)
WAY-641885

>  <BAR_CODE_NO> (2,576)
90476438

>  <LOCATION_CODE> (2,576)
PTNCS

>  <AMOUNT_CURRENT> (2,576)
32.3

$$$$
WAY-642491
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  2  0  0  0  0
 14  2  1  0  0  0  0
 15 11  2  0  0  0  0
 16 13  1  0  0  0  0
 17 20  1  0  0  0  0
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 23 21  2  0  0  0  0
  4  5  2  0  0  0  0
 13 15  1  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,577)
2577

>  <Formula> (2,577)
C17H15ClN2O3

>  <MolWeight> (2,577)
330.7656

>  <PCAT_CMPD_ID> (2,577)
WAY-642491

>  <CNC_ID> (2,577)
359324229

>  <transfer_container_id> (2,577)
PTN000000065

>  <COMPOUND_NUMBER> (2,577)
WAY-642491

>  <BAR_CODE_NO> (2,577)
90477051

>  <LOCATION_CODE> (2,577)
PTNCS

>  <AMOUNT_CURRENT> (2,577)
33

$$$$
WAY-641662
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 13  6  1  0  0  0  0
 14  9  1  0  0  0  0
 15  8  2  0  0  0  0
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 17 11  1  0  0  0  0
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  5  6  1  0  0  0  0
 24 22  2  0  0  0  0
 18 19  1  0  0  0  0
 20 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,578)
2578

>  <Formula> (2,578)
C20H16N4

>  <MolWeight> (2,578)
312.36784

>  <PCAT_CMPD_ID> (2,578)
WAY-641662

>  <CNC_ID> (2,578)
359323400

>  <transfer_container_id> (2,578)
PTN000000065

>  <COMPOUND_NUMBER> (2,578)
WAY-641662

>  <BAR_CODE_NO> (2,578)
90476214

>  <LOCATION_CODE> (2,578)
PTNCS

>  <AMOUNT_CURRENT> (2,578)
32.8

$$$$
WAY-616223
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10 16  2  0  0  0  0
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 29 28  1  0  0  0  0
 11  7  2  0  0  0  0
 20 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,579)
2579

>  <Formula> (2,579)
C22H18N2O4S

>  <MolWeight> (2,579)
406.45432

>  <PCAT_CMPD_ID> (2,579)
WAY-616223

>  <CNC_ID> (2,579)
359321308

>  <transfer_container_id> (2,579)
PTN000000065

>  <COMPOUND_NUMBER> (2,579)
WAY-616223

>  <BAR_CODE_NO> (2,579)
90450204

>  <LOCATION_CODE> (2,579)
PTNCS

>  <AMOUNT_CURRENT> (2,579)
32.5

$$$$
WAY-642961
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,580)
2580

>  <Formula> (2,580)
C25H25N5

>  <MolWeight> (2,580)
395.4995

>  <PCAT_CMPD_ID> (2,580)
WAY-642961

>  <CNC_ID> (2,580)
359324699

>  <transfer_container_id> (2,580)
PTN000000065

>  <COMPOUND_NUMBER> (2,580)
WAY-642961

>  <BAR_CODE_NO> (2,580)
90477528

>  <LOCATION_CODE> (2,580)
PTNCS

>  <AMOUNT_CURRENT> (2,580)
32.8

$$$$
WAY-616047
csChFnd80/10111816222D

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  6 12  1  0  0  0  0
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 10  5  1  0  0  0  0
 11  3  1  0  0  0  0
 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14  9  2  0  0  0  0
 15 11  1  0  0  0  0
 16  4  1  0  0  0  0
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 24 21  1  0  0  0  0
  6  4  2  0  0  0  0
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 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,581)
2581

>  <Formula> (2,581)
C17H19Cl2N3O2

>  <MolWeight> (2,581)
368.25766

>  <PCAT_CMPD_ID> (2,581)
WAY-616047

>  <CNC_ID> (2,581)
359321132

>  <transfer_container_id> (2,581)
PTN000000065

>  <COMPOUND_NUMBER> (2,581)
WAY-616047

>  <BAR_CODE_NO> (2,581)
90450025

>  <LOCATION_CODE> (2,581)
PTNCS

>  <AMOUNT_CURRENT> (2,581)
32.2

$$$$
WAY-624480
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4  2  1  0  0  0  0
  5 10  1  0  0  0  0
  6  1  2  0  0  0  0
  7  5  2  0  0  0  0
  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10 13  1  0  0  0  0
 11  7  1  0  0  0  0
 12  8  2  0  0  0  0
 13 19  1  0  0  0  0
 14  9  1  0  0  0  0
 15  3  1  0  0  0  0
 16  4  1  0  0  0  0
 17  9  2  0  0  0  0
 18 13  2  0  0  0  0
 19 14  1  0  0  0  0
 20 16  1  0  0  0  0
 21 15  1  0  0  0  0
 22 12  1  0  0  0  0
 23 21  1  0  0  0  0
  3  4  2  0  0  0  0
 20 21  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,582)
2582

>  <Formula> (2,582)
C16H18N2O4S

>  <MolWeight> (2,582)
334.39012

>  <PCAT_CMPD_ID> (2,582)
WAY-624480

>  <CNC_ID> (2,582)
359322901

>  <transfer_container_id> (2,582)
PTN000000065

>  <COMPOUND_NUMBER> (2,582)
WAY-624480

>  <BAR_CODE_NO> (2,582)
90458656

>  <LOCATION_CODE> (2,582)
PTNCS

>  <AMOUNT_CURRENT> (2,582)
32.8

$$$$
WAY-333252
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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   14.2824    6.9473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8 13  1  0  0  0  0
  9  3  1  0  0  0  0
 10  6  2  0  0  0  0
 11  7  1  0  0  0  0
 12  7  1  0  0  0  0
 13 12  1  0  0  0  0
 14 11  1  0  0  0  0
 15  8  1  0  0  0  0
 16  9  2  0  0  0  0
 17  2  1  0  0  0  0
 18  5  1  0  0  0  0
 19  9  1  0  0  0  0
 20 15  2  0  0  0  0
 21 15  1  0  0  0  0
 22 19  1  0  0  0  0
 23 22  1  0  0  0  0
 24 21  2  0  0  0  0
 25 20  1  0  0  0  0
 26 24  1  0  0  0  0
  3  4  1  0  0  0  0
 14  8  1  0  0  0  0
 25 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,583)
2583

>  <Formula> (2,583)
C20H25N3O3

>  <MolWeight> (2,583)
355.4308

>  <PCAT_CMPD_ID> (2,583)
WAY-333252

>  <CNC_ID> (2,583)
359331787

>  <transfer_container_id> (2,583)
PTN000000067

>  <COMPOUND_NUMBER> (2,583)
WAY-333252

>  <BAR_CODE_NO> (2,583)
308253

>  <LOCATION_CODE> (2,583)
PTNCS

>  <AMOUNT_CURRENT> (2,583)
32.5

$$$$
WAY-333254
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    8.8666    6.8332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
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 10  8  1  0  0  0  0
 11 10  2  0  0  0  0
 12  6  2  0  0  0  0
 13  7  1  0  0  0  0
 14  7  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 17  9  2  0  0  0  0
 18 11  1  0  0  0  0
 19  2  1  0  0  0  0
 20  5  1  0  0  0  0
 21  9  1  0  0  0  0
 22 18  1  0  0  0  0
 23 10  1  0  0  0  0
 24 23  2  0  0  0  0
 25 24  1  0  0  0  0
 26 21  1  0  0  0  0
 27 26  1  0  0  0  0
  3  4  1  0  0  0  0
 15  8  1  0  0  0  0
 18 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,584)
2584

>  <Formula> (2,584)
C20H24ClN3O3

>  <MolWeight> (2,584)
389.87586

>  <PCAT_CMPD_ID> (2,584)
WAY-333254

>  <CNC_ID> (2,584)
359331789

>  <transfer_container_id> (2,584)
PTN000000067

>  <COMPOUND_NUMBER> (2,584)
WAY-333254

>  <BAR_CODE_NO> (2,584)
308255

>  <LOCATION_CODE> (2,584)
PTNCS

>  <AMOUNT_CURRENT> (2,584)
32.5

$$$$
WAY-329710
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  7  1  1  0  0  0  0
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 10  3  1  0  0  0  0
 11 10  1  0  0  0  0
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 17 13  1  0  0  0  0
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 19  9  1  0  0  0  0
  4  8  1  0  0  0  0
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 12 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,585)
2585

>  <Formula> (2,585)
C13H12FN5

>  <MolWeight> (2,585)
257.2662832

>  <PCAT_CMPD_ID> (2,585)
WAY-329710

>  <CNC_ID> (2,585)
359317078

>  <transfer_container_id> (2,585)
PTN000000065

>  <COMPOUND_NUMBER> (2,585)
WAY-329710

>  <BAR_CODE_NO> (2,585)
304711

>  <LOCATION_CODE> (2,585)
PTNCS

>  <AMOUNT_CURRENT> (2,585)
32.5

$$$$
WAY-332850
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  6 10  1  0  0  0  0
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  9  4  1  0  0  0  0
 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  6  2  0  0  0  0
 13  3  1  0  0  0  0
 14 11  1  0  0  0  0
 15  7  1  0  0  0  0
 16  8  1  0  0  0  0
 17 14  1  0  0  0  0
 18 14  2  0  0  0  0
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  7  8  2  0  0  0  0
  6  5  1  0  0  0  0
 20 19  1  0  0  0  0
 23 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,586)
2586

>  <Formula> (2,586)
C19H19N3O

>  <MolWeight> (2,586)
305.37366

>  <PCAT_CMPD_ID> (2,586)
WAY-332850

>  <CNC_ID> (2,586)
359331385

>  <transfer_container_id> (2,586)
PTN000000067

>  <COMPOUND_NUMBER> (2,586)
WAY-332850

>  <BAR_CODE_NO> (2,586)
307851

>  <LOCATION_CODE> (2,586)
PTNCS

>  <AMOUNT_CURRENT> (2,586)
32.5

$$$$
WAY-643296
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  3  2  2  0  0  0  0
  4  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  7 12  1  0  0  0  0
  8  7  2  0  0  0  0
  9  1  1  0  0  0  0
 10  9  2  0  0  0  0
 11  4  1  0  0  0  0
 12  1  1  0  0  0  0
 13 11  1  0  0  0  0
 14  2  1  0  0  0  0
 15 11  2  0  0  0  0
 16 13  1  0  0  0  0
 17 15  1  0  0  0  0
 18 22  1  0  0  0  0
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 20  9  1  0  0  0  0
 21 10  1  0  0  0  0
 22 14  1  0  0  0  0
 23 20  2  0  0  0  0
 24 23  1  0  0  0  0
 10  3  1  0  0  0  0
  4  5  2  0  0  0  0
 24 21  2  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,587)
2587

>  <Formula> (2,587)
C17H14N4OS2

>  <MolWeight> (2,587)
354.44926

>  <PCAT_CMPD_ID> (2,587)
WAY-643296

>  <CNC_ID> (2,587)
359325034

>  <transfer_container_id> (2,587)
PTN000000065

>  <COMPOUND_NUMBER> (2,587)
WAY-643296

>  <BAR_CODE_NO> (2,587)
90477867

>  <LOCATION_CODE> (2,587)
PTNCS

>  <AMOUNT_CURRENT> (2,587)
32.7

$$$$
WAY-332151
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
   -6.6250    4.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  2  2  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  8  2  0  0  0  0
 10  7  1  0  0  0  0
 11 17  1  0  0  0  0
 12 11  1  0  0  0  0
 13  9  1  0  0  0  0
 14  7  2  0  0  0  0
 15 10  1  0  0  0  0
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 17 16  1  0  0  0  0
 18 15  1  0  0  0  0
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 21 13  2  0  0  0  0
 22 12  1  0  0  0  0
 23  5  1  0  0  0  0
 24 25  2  0  0  0  0
 25 21  1  0  0  0  0
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 27 24  1  0  0  0  0
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 29 28  1  0  0  0  0
  2  3  1  0  0  0  0
 11 18  1  0  0  0  0
  9  6  1  0  0  0  0
 26 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,588)
2588

>  <Formula> (2,588)
C20H21FN4O3S

>  <MolWeight> (2,588)
416.4691432

>  <PCAT_CMPD_ID> (2,588)
WAY-332151

>  <CNC_ID> (2,588)
359330690

>  <transfer_container_id> (2,588)
PTN000000067

>  <COMPOUND_NUMBER> (2,588)
WAY-332151

>  <BAR_CODE_NO> (2,588)
307152

>  <LOCATION_CODE> (2,588)
PTNCS

>  <AMOUNT_CURRENT> (2,588)
32.5

$$$$
WAY-331229
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    7.6500  -11.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
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 10  4  1  0  0  0  0
 11 13  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  1  0  0  0  0
 14  6  2  0  0  0  0
 15  7  2  0  0  0  0
 16 12  2  0  0  0  0
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 18  3  1  0  0  0  0
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  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 30 28  2  0  0  0  0
 26 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,589)
2589

>  <Formula> (2,589)
C22H27N5O3

>  <MolWeight> (2,589)
409.48148

>  <PCAT_CMPD_ID> (2,589)
WAY-331229

>  <CNC_ID> (2,589)
359318584

>  <transfer_container_id> (2,589)
PTN000000065

>  <COMPOUND_NUMBER> (2,589)
WAY-331229

>  <BAR_CODE_NO> (2,589)
306230

>  <LOCATION_CODE> (2,589)
PTNCS

>  <AMOUNT_CURRENT> (2,589)
32.5

$$$$
WAY-333201
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
    3.3613    3.6805    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  8  2  0  0  0  0
 12  9  1  0  0  0  0
 13 11  1  0  0  0  0
 14  1  1  0  0  0  0
 15  6  1  0  0  0  0
 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18 15  2  0  0  0  0
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 20 17  1  0  0  0  0
  3  5  1  0  0  0  0
 16 19  2  0  0  0  0
 13 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,590)
2590

>  <Formula> (2,590)
C16H17NO2S

>  <MolWeight> (2,590)
287.37668

>  <PCAT_CMPD_ID> (2,590)
WAY-333201

>  <CNC_ID> (2,590)
359331736

>  <transfer_container_id> (2,590)
PTN000000067

>  <COMPOUND_NUMBER> (2,590)
WAY-333201

>  <BAR_CODE_NO> (2,590)
308202

>  <LOCATION_CODE> (2,590)
PTNCS

>  <AMOUNT_CURRENT> (2,590)
32.5

$$$$
WAY-624703
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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    0.3250   -0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 31 28  2  0  0  0  0
 32 30  2  0  0  0  0
  4  2  1  0  0  0  0
 13 10  2  0  0  0  0
 31 32  1  0  0  0  0
 20 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,591)
2591

>  <Formula> (2,591)
C25H26N2O4S

>  <MolWeight> (2,591)
450.54994

>  <PCAT_CMPD_ID> (2,591)
WAY-624703

>  <CNC_ID> (2,591)
359323124

>  <transfer_container_id> (2,591)
PTN000000065

>  <COMPOUND_NUMBER> (2,591)
WAY-624703

>  <BAR_CODE_NO> (2,591)
90458879

>  <LOCATION_CODE> (2,591)
PTNCS

>  <AMOUNT_CURRENT> (2,591)
32.5

$$$$
WAY-332253
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.9500   -4.4250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.1500   -4.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5  7  1  0  0  0  0
  6  5  1  0  0  0  0
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  8  1  2  0  0  0  0
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 10  4  2  0  0  0  0
 11  2  2  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14 15  1  0  0  0  0
 15 12  1  0  0  0  0
 16  6  2  0  0  0  0
 17 14  2  0  0  0  0
 18  3  1  0  0  0  0
 19 17  1  0  0  0  0
 20 21  1  0  0  0  0
 21 18  1  0  0  0  0
 22 14  1  0  0  0  0
 23 17  1  0  0  0  0
 24 22  2  0  0  0  0
 25 24  1  0  0  0  0
 13 10  1  0  0  0  0
 20  5  1  0  0  0  0
 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,592)
2592

>  <Formula> (2,592)
C16H19ClN4O3S

>  <MolWeight> (2,592)
382.86506

>  <PCAT_CMPD_ID> (2,592)
WAY-332253

>  <CNC_ID> (2,592)
359330789

>  <transfer_container_id> (2,592)
PTN000000067

>  <COMPOUND_NUMBER> (2,592)
WAY-332253

>  <BAR_CODE_NO> (2,592)
307254

>  <LOCATION_CODE> (2,592)
PTNCS

>  <AMOUNT_CURRENT> (2,592)
32.5

$$$$
WAY-332276
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  7  3  1  0  0  0  0
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 10  4  2  0  0  0  0
 11  2  2  0  0  0  0
 12 11  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  2  0  0  0  0
 15 13  1  0  0  0  0
 16  3  1  0  0  0  0
 17 18  2  0  0  0  0
 18 15  1  0  0  0  0
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 26 21  1  0  0  0  0
 12 10  1  0  0  0  0
 20  5  1  0  0  0  0
 19 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,593)
2593

>  <Formula> (2,593)
C17H22N4O4S

>  <MolWeight> (2,593)
378.44598

>  <PCAT_CMPD_ID> (2,593)
WAY-332276

>  <CNC_ID> (2,593)
359330812

>  <transfer_container_id> (2,593)
PTN000000067

>  <COMPOUND_NUMBER> (2,593)
WAY-332276

>  <BAR_CODE_NO> (2,593)
307277

>  <LOCATION_CODE> (2,593)
PTNCS

>  <AMOUNT_CURRENT> (2,593)
32.5

$$$$
WAY-332252
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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   10.0125   -3.3125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  4  2  0  0  0  0
 12  2  2  0  0  0  0
 13 12  1  0  0  0  0
 14  5  2  0  0  0  0
 15  8  1  0  0  0  0
 16  3  1  0  0  0  0
 17 22  1  0  0  0  0
 18 17  1  0  0  0  0
 19 24  1  0  0  0  0
 20 15  2  0  0  0  0
 21 15  1  0  0  0  0
 22 21  2  0  0  0  0
 23 20  1  0  0  0  0
 24 16  1  0  0  0  0
 13 11  1  0  0  0  0
 19  6  1  0  0  0  0
 23 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,594)
2594

>  <Formula> (2,594)
C15H17ClN4O3S

>  <MolWeight> (2,594)
368.83848

>  <PCAT_CMPD_ID> (2,594)
WAY-332252

>  <CNC_ID> (2,594)
359330788

>  <transfer_container_id> (2,594)
PTN000000067

>  <COMPOUND_NUMBER> (2,594)
WAY-332252

>  <BAR_CODE_NO> (2,594)
307253

>  <LOCATION_CODE> (2,594)
PTNCS

>  <AMOUNT_CURRENT> (2,594)
32.5

$$$$
WAY-332274
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   12.9500   -4.4250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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 25 19  1  0  0  0  0
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 20  6  1  0  0  0  0
 18 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,595)
2595

>  <Formula> (2,595)
C16H20N4O3S2

>  <MolWeight> (2,595)
380.485

>  <PCAT_CMPD_ID> (2,595)
WAY-332274

>  <CNC_ID> (2,595)
359330810

>  <transfer_container_id> (2,595)
PTN000000067

>  <COMPOUND_NUMBER> (2,595)
WAY-332274

>  <BAR_CODE_NO> (2,595)
307275

>  <LOCATION_CODE> (2,595)
PTNCS

>  <AMOUNT_CURRENT> (2,595)
32.5

$$$$
WAY-332267
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  9 15  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  4  2  0  0  0  0
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 14 13  1  0  0  0  0
 15 19  2  0  0  0  0
 16  5  2  0  0  0  0
 17  9  2  0  0  0  0
 18  8  1  0  0  0  0
 19 24  1  0  0  0  0
 20 23  2  0  0  0  0
 21  3  1  0  0  0  0
 22  9  1  0  0  0  0
 23 18  1  0  0  0  0
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 14 12  1  0  0  0  0
 25  6  1  0  0  0  0
 15 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,596)
2596

>  <Formula> (2,596)
C18H22N4O5S

>  <MolWeight> (2,596)
406.45608

>  <PCAT_CMPD_ID> (2,596)
WAY-332267

>  <CNC_ID> (2,596)
359330803

>  <transfer_container_id> (2,596)
PTN000000067

>  <COMPOUND_NUMBER> (2,596)
WAY-332267

>  <BAR_CODE_NO> (2,596)
307268

>  <LOCATION_CODE> (2,596)
PTNCS

>  <AMOUNT_CURRENT> (2,596)
32.5

$$$$
WAY-332247
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  4  2  0  0  0  0
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 14 18  2  0  0  0  0
 15  8  1  0  0  0  0
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 17  5  2  0  0  0  0
 18 15  1  0  0  0  0
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 20  3  1  0  0  0  0
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 25 14  1  0  0  0  0
 13 11  1  0  0  0  0
 23  6  1  0  0  0  0
 14 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,597)
2597

>  <Formula> (2,597)
C16H19BrN4O3S

>  <MolWeight> (2,597)
427.31606

>  <PCAT_CMPD_ID> (2,597)
WAY-332247

>  <CNC_ID> (2,597)
359330783

>  <transfer_container_id> (2,597)
PTN000000067

>  <COMPOUND_NUMBER> (2,597)
WAY-332247

>  <BAR_CODE_NO> (2,597)
307248

>  <LOCATION_CODE> (2,597)
PTNCS

>  <AMOUNT_CURRENT> (2,597)
32.5

$$$$
WAY-623976
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 20 23  2  0  0  0  0
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 16  8  2  0  0  0  0
  9 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,598)
2598

>  <Formula> (2,598)
C23H18N4O3S2

>  <MolWeight> (2,598)
462.54402

>  <PCAT_CMPD_ID> (2,598)
WAY-623976

>  <CNC_ID> (2,598)
359322596

>  <transfer_container_id> (2,598)
PTN000000065

>  <COMPOUND_NUMBER> (2,598)
WAY-623976

>  <BAR_CODE_NO> (2,598)
90458149

>  <LOCATION_CODE> (2,598)
PTNCS

>  <AMOUNT_CURRENT> (2,598)
32.6

$$$$
WAY-624683
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 18  8  2  0  0  0  0
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 20 14  1  0  0  0  0
 21 14  2  0  0  0  0
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 24  6  1  0  0  0  0
 25 21  1  0  0  0  0
 26 20  2  0  0  0  0
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 28  9  1  0  0  0  0
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 31 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,599)
2599

>  <Formula> (2,599)
C23H20FN3O4

>  <MolWeight> (2,599)
421.4210032

>  <PCAT_CMPD_ID> (2,599)
WAY-624683

>  <CNC_ID> (2,599)
359323104

>  <transfer_container_id> (2,599)
PTN000000065

>  <COMPOUND_NUMBER> (2,599)
WAY-624683

>  <BAR_CODE_NO> (2,599)
90458859

>  <LOCATION_CODE> (2,599)
PTNCS

>  <AMOUNT_CURRENT> (2,599)
33

$$$$
WAY-278588
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
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 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
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 13 15  1  0  0  0  0
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 15 17  2  0  0  0  0
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 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,600)
2600

>  <Formula> (2,600)
C14H9BrN2OS2

>  <MolWeight> (2,600)
365.26806

>  <PCAT_CMPD_ID> (2,600)
WAY-278588

>  <CNC_ID> (2,600)
359327308

>  <transfer_container_id> (2,600)
PTN000000067

>  <COMPOUND_NUMBER> (2,600)
WAY-278588

>  <BAR_CODE_NO> (2,600)
389243

>  <LOCATION_CODE> (2,600)
PTNCS

>  <AMOUNT_CURRENT> (2,600)
32.5

$$$$
WAY-624747
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  7  2  0  0  0  0
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 13  2  1  0  0  0  0
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 15  1  1  0  0  0  0
 16  5  1  0  0  0  0
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 18  5  2  0  0  0  0
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 22 20  2  0  0  0  0
 23 21  2  0  0  0  0
 17 10  2  0  0  0  0
 22 23  1  0  0  0  0
  6  3  2  0  0  0  0
 12  9  1  0  0  0  0
M  END
>  <Mol_ID> (2,601)
2601

>  <Formula> (2,601)
C17H15N3O2S

>  <MolWeight> (2,601)
325.3849

>  <PCAT_CMPD_ID> (2,601)
WAY-624747

>  <CNC_ID> (2,601)
359323168

>  <transfer_container_id> (2,601)
PTN000000065

>  <COMPOUND_NUMBER> (2,601)
WAY-624747

>  <BAR_CODE_NO> (2,601)
90458924

>  <LOCATION_CODE> (2,601)
PTNCS

>  <AMOUNT_CURRENT> (2,601)
32.6

$$$$
WAY-643557
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  6  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  1  0  0  0  0
 14  7  1  0  0  0  0
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  5  4  2  0  0  0  0
 10  8  1  0  0  0  0
 24 20  2  0  0  0  0
 28 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,602)
2602

>  <Formula> (2,602)
C22H18N4OS

>  <MolWeight> (2,602)
386.46952

>  <PCAT_CMPD_ID> (2,602)
WAY-643557

>  <CNC_ID> (2,602)
359325295

>  <transfer_container_id> (2,602)
PTN000000065

>  <COMPOUND_NUMBER> (2,602)
WAY-643557

>  <BAR_CODE_NO> (2,602)
90478129

>  <LOCATION_CODE> (2,602)
PTNCS

>  <AMOUNT_CURRENT> (2,602)
32.3

$$$$
WAY-642289
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 10 12  1  0  0  0  0
 11  9  2  0  0  0  0
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 13 10  1  0  0  0  0
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 17  5  1  0  0  0  0
 18  6  1  0  0  0  0
 19  7  1  0  0  0  0
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 11  8  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,603)
2603

>  <Formula> (2,603)
C14H15N3OS

>  <MolWeight> (2,603)
273.3534

>  <PCAT_CMPD_ID> (2,603)
WAY-642289

>  <CNC_ID> (2,603)
359324027

>  <transfer_container_id> (2,603)
PTN000000065

>  <COMPOUND_NUMBER> (2,603)
WAY-642289

>  <BAR_CODE_NO> (2,603)
90476848

>  <LOCATION_CODE> (2,603)
PTNCS

>  <AMOUNT_CURRENT> (2,603)
32.8

$$$$
WAY-616131
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  7  1  0  0  0  0
 12 14  2  0  0  0  0
 13 17  1  0  0  0  0
 14  8  1  0  0  0  0
 15 11  2  0  0  0  0
 16 13  2  0  0  0  0
 17 20  1  0  0  0  0
 18  5  1  0  0  0  0
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 23  6  1  0  0  0  0
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 25 10  1  0  0  0  0
 26 25  2  0  0  0  0
 27 24  2  0  0  0  0
  6 12  1  0  0  0  0
  9 10  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,604)
2604

>  <Formula> (2,604)
C18H15Cl2N3O3S

>  <MolWeight> (2,604)
424.301

>  <PCAT_CMPD_ID> (2,604)
WAY-616131

>  <CNC_ID> (2,604)
359321216

>  <transfer_container_id> (2,604)
PTN000000065

>  <COMPOUND_NUMBER> (2,604)
WAY-616131

>  <BAR_CODE_NO> (2,604)
90450111

>  <LOCATION_CODE> (2,604)
PTNCS

>  <AMOUNT_CURRENT> (2,604)
32.6

$$$$
WAY-643452
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  5  2  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
 10  1  1  0  0  0  0
 11  9  2  0  0  0  0
 12  7  2  0  0  0  0
 13  8  1  0  0  0  0
 14 16  2  0  0  0  0
 15 12  1  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18 14  1  0  0  0  0
 19 10  1  0  0  0  0
 20 10  2  0  0  0  0
 21 20  1  0  0  0  0
 22 19  2  0  0  0  0
 23 21  2  0  0  0  0
  4  5  1  0  0  0  0
 23 22  1  0  0  0  0
 13 15  2  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,605)
2605

>  <Formula> (2,605)
C16H11N5S2

>  <MolWeight> (2,605)
337.42204

>  <PCAT_CMPD_ID> (2,605)
WAY-643452

>  <CNC_ID> (2,605)
359325190

>  <transfer_container_id> (2,605)
PTN000000065

>  <COMPOUND_NUMBER> (2,605)
WAY-643452

>  <BAR_CODE_NO> (2,605)
90478024

>  <LOCATION_CODE> (2,605)
PTNCS

>  <AMOUNT_CURRENT> (2,605)
32.8

$$$$
WAY-643331
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4 13  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  2  0  0  0  0
  7  1  2  0  0  0  0
  8  3  1  0  0  0  0
  9  3  1  0  0  0  0
 10 11  1  0  0  0  0
 11 22  1  0  0  0  0
 12  2  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 10  1  0  0  0  0
 16  5  2  0  0  0  0
 17 11  2  0  0  0  0
 18 17  1  0  0  0  0
 19 12  1  0  0  0  0
 20  2  1  0  0  0  0
 21  5  1  0  0  0  0
 22 23  1  0  0  0  0
 23 21  1  0  0  0  0
 24 12  1  0  0  0  0
 25 20  2  0  0  0  0
 26 25  1  0  0  0  0
  4 14  1  0  0  0  0
 26 24  2  0  0  0  0
 15 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,606)
2606

>  <Formula> (2,606)
C18H21BrN2O3S2

>  <MolWeight> (2,606)
457.40494

>  <PCAT_CMPD_ID> (2,606)
WAY-643331

>  <CNC_ID> (2,606)
359325069

>  <transfer_container_id> (2,606)
PTN000000065

>  <COMPOUND_NUMBER> (2,606)
WAY-643331

>  <BAR_CODE_NO> (2,606)
90477902

>  <LOCATION_CODE> (2,606)
PTNCS

>  <AMOUNT_CURRENT> (2,606)
32.7

$$$$
WAY-642559
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10 28  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
 13  5  1  0  0  0  0
 14  3  2  0  0  0  0
 15  4  1  0  0  0  0
 16  4  1  0  0  0  0
 17 26  2  0  0  0  0
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 20 15  1  0  0  0  0
 21  3  1  0  0  0  0
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 25 13  2  0  0  0  0
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 29 11  1  0  0  0  0
 30 10  1  0  0  0  0
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  6  7  2  0  0  0  0
 29 10  1  0  0  0  0
  5 20  1  0  0  0  0
 17 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,607)
2607

>  <Formula> (2,607)
C22H29N5O3S

>  <MolWeight> (2,607)
443.56236

>  <PCAT_CMPD_ID> (2,607)
WAY-642559

>  <CNC_ID> (2,607)
359324297

>  <transfer_container_id> (2,607)
PTN000000065

>  <COMPOUND_NUMBER> (2,607)
WAY-642559

>  <BAR_CODE_NO> (2,607)
90477120

>  <LOCATION_CODE> (2,607)
PTNCS

>  <AMOUNT_CURRENT> (2,607)
32.9

$$$$
WAY-332738
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    6.9927    9.6427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
 11  1  2  0  0  0  0
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 20 19  2  0  0  0  0
 15  6  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,608)
2608

>  <Formula> (2,608)
C24H32N4O2S

>  <MolWeight> (2,608)
440.60148

>  <PCAT_CMPD_ID> (2,608)
WAY-332738

>  <CNC_ID> (2,608)
359331274

>  <transfer_container_id> (2,608)
PTN000000067

>  <COMPOUND_NUMBER> (2,608)
WAY-332738

>  <BAR_CODE_NO> (2,608)
307739

>  <LOCATION_CODE> (2,608)
PTNCS

>  <AMOUNT_CURRENT> (2,608)
32.5

$$$$
WAY-332750
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  6 17  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10  9  1  0  0  0  0
 11  6  1  0  0  0  0
 12  1  2  0  0  0  0
 13  4  1  0  0  0  0
 14  4  1  0  0  0  0
 15  2  2  0  0  0  0
 16 13  1  0  0  0  0
 17 14  1  0  0  0  0
 18  9  2  0  0  0  0
 19 10  1  0  0  0  0
 20 18  1  0  0  0  0
 21 11  1  0  0  0  0
 22 11  2  0  0  0  0
 23 24  2  0  0  0  0
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 25 21  2  0  0  0  0
 26 23  1  0  0  0  0
 27  7  1  0  0  0  0
 28  7  1  0  0  0  0
 29  8  1  0  0  0  0
 30 27  1  0  0  0  0
 31 28  1  0  0  0  0
 32 31  1  0  0  0  0
 32 30  1  0  0  0  0
 20 19  2  0  0  0  0
 16  6  1  0  0  0  0
 25 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,609)
2609

>  <Formula> (2,609)
C24H31FN4O2S

>  <MolWeight> (2,609)
458.5919432

>  <PCAT_CMPD_ID> (2,609)
WAY-332750

>  <CNC_ID> (2,609)
359331286

>  <transfer_container_id> (2,609)
PTN000000067

>  <COMPOUND_NUMBER> (2,609)
WAY-332750

>  <BAR_CODE_NO> (2,609)
307751

>  <LOCATION_CODE> (2,609)
PTNCS

>  <AMOUNT_CURRENT> (2,609)
32.5

$$$$
WAY-331128
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.3125   -4.4750    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5 15  1  0  0  0  0
  6  5  1  0  0  0  0
  7 20  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  4  2  0  0  0  0
 13  2  2  0  0  0  0
 14 13  1  0  0  0  0
 15 25  1  0  0  0  0
 16  3  1  0  0  0  0
 17  3  1  0  0  0  0
 18  6  1  0  0  0  0
 19  6  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22  5  2  0  0  0  0
 23  9  2  0  0  0  0
 24 16  1  0  0  0  0
 25 17  1  0  0  0  0
 26  8  2  0  0  0  0
 27  9  1  0  0  0  0
 28 26  1  0  0  0  0
 29 28  2  0  0  0  0
 30 23  1  0  0  0  0
 24 15  1  0  0  0  0
 12 14  1  0  0  0  0
 21  7  1  0  0  0  0
 29 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,610)
2610

>  <Formula> (2,610)
C21H29N5O3S

>  <MolWeight> (2,610)
431.55166

>  <PCAT_CMPD_ID> (2,610)
WAY-331128

>  <CNC_ID> (2,610)
359318483

>  <transfer_container_id> (2,610)
PTN000000065

>  <COMPOUND_NUMBER> (2,610)
WAY-331128

>  <BAR_CODE_NO> (2,610)
306129

>  <LOCATION_CODE> (2,610)
PTNCS

>  <AMOUNT_CURRENT> (2,610)
32.5

$$$$
WAY-332771
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
    6.9939   11.0040    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6 14  1  0  0  0  0
  7  3  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  5  1  0  0  0  0
 13  5  1  0  0  0  0
 14 13  1  0  0  0  0
 15 12  1  0  0  0  0
 16  7  2  0  0  0  0
 17  8  1  0  0  0  0
 18 16  1  0  0  0  0
 19  9  2  0  0  0  0
 20  9  1  0  0  0  0
 21  1  1  0  0  0  0
 22 24  1  0  0  0  0
 23 19  1  0  0  0  0
 24 20  2  0  0  0  0
 25 22  1  0  0  0  0
 26  2  1  0  0  0  0
 27 21  1  0  0  0  0
 18 17  2  0  0  0  0
 15  6  1  0  0  0  0
 23 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,611)
2611

>  <Formula> (2,611)
C19H26FN3O2S2

>  <MolWeight> (2,611)
411.5570432

>  <PCAT_CMPD_ID> (2,611)
WAY-332771

>  <CNC_ID> (2,611)
359331307

>  <transfer_container_id> (2,611)
PTN000000067

>  <COMPOUND_NUMBER> (2,611)
WAY-332771

>  <BAR_CODE_NO> (2,611)
307772

>  <LOCATION_CODE> (2,611)
PTNCS

>  <AMOUNT_CURRENT> (2,611)
32.5

$$$$
WAY-333002
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  9  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  2  0  0  0  0
 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  3  1  0  0  0  0
 14  8  2  0  0  0  0
 15 10  2  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18 20  2  0  0  0  0
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 22 12  1  0  0  0  0
 23 12  1  0  0  0  0
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 25 23  1  0  0  0  0
  7  8  1  0  0  0  0
  5  4  2  0  0  0  0
 18 19  1  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,612)
2612

>  <Formula> (2,612)
C16H15FN6O2

>  <MolWeight> (2,612)
342.3277032

>  <PCAT_CMPD_ID> (2,612)
WAY-333002

>  <CNC_ID> (2,612)
359331537

>  <transfer_container_id> (2,612)
PTN000000067

>  <COMPOUND_NUMBER> (2,612)
WAY-333002

>  <BAR_CODE_NO> (2,612)
308003

>  <LOCATION_CODE> (2,612)
PTNCS

>  <AMOUNT_CURRENT> (2,612)
32.5

$$$$
WAY-624460
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11  4  2  0  0  0  0
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M  END
>  <Mol_ID> (2,613)
2613

>  <Formula> (2,613)
C14H11N3O2S

>  <MolWeight> (2,613)
285.32104

>  <PCAT_CMPD_ID> (2,613)
WAY-624460

>  <CNC_ID> (2,613)
359322881

>  <transfer_container_id> (2,613)
PTN000000065

>  <COMPOUND_NUMBER> (2,613)
WAY-624460

>  <BAR_CODE_NO> (2,613)
90458636

>  <LOCATION_CODE> (2,613)
PTNCS

>  <AMOUNT_CURRENT> (2,613)
32

$$$$
WAY-643480
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 12  3  1  0  0  0  0
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 26 21  1  0  0  0  0
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  5  4  2  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,614)
2614

>  <Formula> (2,614)
C19H25N3O3S

>  <MolWeight> (2,614)
375.4851

>  <PCAT_CMPD_ID> (2,614)
WAY-643480

>  <CNC_ID> (2,614)
359325218

>  <transfer_container_id> (2,614)
PTN000000065

>  <COMPOUND_NUMBER> (2,614)
WAY-643480

>  <BAR_CODE_NO> (2,614)
90478052

>  <LOCATION_CODE> (2,614)
PTNCS

>  <AMOUNT_CURRENT> (2,614)
32.7

$$$$
WAY-278714
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 20 21  2  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,615)
2615

>  <Formula> (2,615)
C20H14FN3O3S

>  <MolWeight> (2,615)
395.4068632

>  <PCAT_CMPD_ID> (2,615)
WAY-278714

>  <CNC_ID> (2,615)
359327434

>  <transfer_container_id> (2,615)
PTN000000067

>  <COMPOUND_NUMBER> (2,615)
WAY-278714

>  <BAR_CODE_NO> (2,615)
389369

>  <LOCATION_CODE> (2,615)
PTNCS

>  <AMOUNT_CURRENT> (2,615)
32.5

$$$$
WAY-330383
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
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M  END
>  <Mol_ID> (2,616)
2616

>  <Formula> (2,616)
C22H23N3O4S

>  <MolWeight> (2,616)
425.50072

>  <PCAT_CMPD_ID> (2,616)
WAY-330383

>  <CNC_ID> (2,616)
359317738

>  <transfer_container_id> (2,616)
PTN000000065

>  <COMPOUND_NUMBER> (2,616)
WAY-330383

>  <BAR_CODE_NO> (2,616)
305384

>  <LOCATION_CODE> (2,616)
PTNCS

>  <AMOUNT_CURRENT> (2,616)
32.5

$$$$
WAY-330400
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 27 19  2  0  0  0  0
 31 26  1  0  0  0  0
 20 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,617)
2617

>  <Formula> (2,617)
C23H25N3O4S

>  <MolWeight> (2,617)
439.5273

>  <PCAT_CMPD_ID> (2,617)
WAY-330400

>  <CNC_ID> (2,617)
359317755

>  <transfer_container_id> (2,617)
PTN000000065

>  <COMPOUND_NUMBER> (2,617)
WAY-330400

>  <BAR_CODE_NO> (2,617)
305401

>  <LOCATION_CODE> (2,617)
PTNCS

>  <AMOUNT_CURRENT> (2,617)
32.5

$$$$
WAY-334256
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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  2 13  1  0  0  0  0
 29 16  1  0  0  0  0
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M  END
>  <Mol_ID> (2,618)
2618

>  <Formula> (2,618)
C24H24ClFN4O

>  <MolWeight> (2,618)
438.9249632

>  <PCAT_CMPD_ID> (2,618)
WAY-334256

>  <CNC_ID> (2,618)
359332789

>  <transfer_container_id> (2,618)
PTN000000067

>  <COMPOUND_NUMBER> (2,618)
WAY-334256

>  <BAR_CODE_NO> (2,618)
309257

>  <LOCATION_CODE> (2,618)
PTNCS

>  <AMOUNT_CURRENT> (2,618)
32.5

$$$$
WAY-334265
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 11  2  1  0  0  0  0
 27 22  2  0  0  0  0
 21 15  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (2,619)
2619

>  <Formula> (2,619)
C24H31FN4O

>  <MolWeight> (2,619)
410.5275432

>  <PCAT_CMPD_ID> (2,619)
WAY-334265

>  <CNC_ID> (2,619)
359332798

>  <transfer_container_id> (2,619)
PTN000000067

>  <COMPOUND_NUMBER> (2,619)
WAY-334265

>  <BAR_CODE_NO> (2,619)
309266

>  <LOCATION_CODE> (2,619)
PTNCS

>  <AMOUNT_CURRENT> (2,619)
32.5

$$$$
WAY-334279
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  9  1  0  0  0  0
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 13  3  2  0  0  0  0
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 16  3  1  0  0  0  0
 17 14  1  0  0  0  0
 18  8  1  0  0  0  0
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 11  2  1  0  0  0  0
 26 22  2  0  0  0  0
 21 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,620)
2620

>  <Formula> (2,620)
C19H23FN4O2

>  <MolWeight> (2,620)
358.4099232

>  <PCAT_CMPD_ID> (2,620)
WAY-334279

>  <CNC_ID> (2,620)
359332812

>  <transfer_container_id> (2,620)
PTN000000067

>  <COMPOUND_NUMBER> (2,620)
WAY-334279

>  <BAR_CODE_NO> (2,620)
309280

>  <LOCATION_CODE> (2,620)
PTNCS

>  <AMOUNT_CURRENT> (2,620)
32.5

$$$$
WAY-334282
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 16  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,621)
2621

>  <Formula> (2,621)
C21H24N4O2S2

>  <MolWeight> (2,621)
428.57086

>  <PCAT_CMPD_ID> (2,621)
WAY-334282

>  <CNC_ID> (2,621)
359332815

>  <transfer_container_id> (2,621)
PTN000000067

>  <COMPOUND_NUMBER> (2,621)
WAY-334282

>  <BAR_CODE_NO> (2,621)
309283

>  <LOCATION_CODE> (2,621)
PTNCS

>  <AMOUNT_CURRENT> (2,621)
32.5

$$$$
WAY-334283
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 17  5  1  0  0  0  0
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 19  9  1  0  0  0  0
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 22 20  1  0  0  0  0
 16  5  1  0  0  0  0
 18 26  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (2,622)
2622

>  <Formula> (2,622)
C23H24F2N4O2S

>  <MolWeight> (2,622)
458.5240664

>  <PCAT_CMPD_ID> (2,622)
WAY-334283

>  <CNC_ID> (2,622)
359332816

>  <transfer_container_id> (2,622)
PTN000000067

>  <COMPOUND_NUMBER> (2,622)
WAY-334283

>  <BAR_CODE_NO> (2,622)
309284

>  <LOCATION_CODE> (2,622)
PTNCS

>  <AMOUNT_CURRENT> (2,622)
32.5

$$$$
WAY-334285
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
 11  2  1  0  0  0  0
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 14  3  1  0  0  0  0
 15 17  2  0  0  0  0
 16  1  1  0  0  0  0
 17  9  1  0  0  0  0
 18  9  2  0  0  0  0
 19 23  2  0  0  0  0
 20 14  2  0  0  0  0
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  3 13  1  0  0  0  0
 15 19  1  0  0  0  0
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M  END
>  <Mol_ID> (2,623)
2623

>  <Formula> (2,623)
C19H26N4O2S

>  <MolWeight> (2,623)
374.50034

>  <PCAT_CMPD_ID> (2,623)
WAY-334285

>  <CNC_ID> (2,623)
359332818

>  <transfer_container_id> (2,623)
PTN000000067

>  <COMPOUND_NUMBER> (2,623)
WAY-334285

>  <BAR_CODE_NO> (2,623)
309286

>  <LOCATION_CODE> (2,623)
PTNCS

>  <AMOUNT_CURRENT> (2,623)
32.5

$$$$
WAY-334298
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  6  1  0  0  0  0
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 13  2  1  0  0  0  0
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 25 28  2  0  0  0  0
 26  9  2  0  0  0  0
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 15  4  1  0  0  0  0
 16 25  1  0  0  0  0
 21 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,624)
2624

>  <Formula> (2,624)
C23H25FN4O2S

>  <MolWeight> (2,624)
440.5336032

>  <PCAT_CMPD_ID> (2,624)
WAY-334298

>  <CNC_ID> (2,624)
359332831

>  <transfer_container_id> (2,624)
PTN000000067

>  <COMPOUND_NUMBER> (2,624)
WAY-334298

>  <BAR_CODE_NO> (2,624)
309299

>  <LOCATION_CODE> (2,624)
PTNCS

>  <AMOUNT_CURRENT> (2,624)
32.5

$$$$
WAY-334315
csChFnd80/10111816222D

 25 26  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  1  0  0  0  0
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 16  6  2  0  0  0  0
 17  5  1  0  0  0  0
 18 23  1  0  0  0  0
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 20  3  1  0  0  0  0
 21  7  1  0  0  0  0
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 19  4  1  0  0  0  0
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M  END
>  <Mol_ID> (2,625)
2625

>  <Formula> (2,625)
C15H16BrClN4O3S

>  <MolWeight> (2,625)
447.73454

>  <PCAT_CMPD_ID> (2,625)
WAY-334315

>  <CNC_ID> (2,625)
359332848

>  <transfer_container_id> (2,625)
PTN000000067

>  <COMPOUND_NUMBER> (2,625)
WAY-334315

>  <BAR_CODE_NO> (2,625)
309316

>  <LOCATION_CODE> (2,625)
PTNCS

>  <AMOUNT_CURRENT> (2,625)
32.5

$$$$
WAY-334318
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  3  1  0  0  0  0
 12  2  2  0  0  0  0
 13  4  2  0  0  0  0
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 15  6  2  0  0  0  0
 16 10  1  0  0  0  0
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  3  6  1  0  0  0  0
 16 14  1  0  0  0  0
 20 19  1  0  0  0  0
 27 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,626)
2626

>  <Formula> (2,626)
C20H17N3O4

>  <MolWeight> (2,626)
363.36668

>  <PCAT_CMPD_ID> (2,626)
WAY-334318

>  <CNC_ID> (2,626)
359332851

>  <transfer_container_id> (2,626)
PTN000000067

>  <COMPOUND_NUMBER> (2,626)
WAY-334318

>  <BAR_CODE_NO> (2,626)
309319

>  <LOCATION_CODE> (2,626)
PTNCS

>  <AMOUNT_CURRENT> (2,626)
32.5

$$$$
WAY-334319
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10 11  1  0  0  0  0
 11 14  2  0  0  0  0
 12  2  2  0  0  0  0
 13 21  1  0  0  0  0
 14  8  1  0  0  0  0
 15  4  2  0  0  0  0
 16  5  2  0  0  0  0
 17 10  1  0  0  0  0
 18 13  1  0  0  0  0
 19  9  1  0  0  0  0
 20  9  2  0  0  0  0
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 22 14  1  0  0  0  0
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 28 18  1  0  0  0  0
 29 26  1  0  0  0  0
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  6  3  2  0  0  0  0
 10 13  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,627)
2627

>  <Formula> (2,627)
C20H17N3O6

>  <MolWeight> (2,627)
395.36548

>  <PCAT_CMPD_ID> (2,627)
WAY-334319

>  <CNC_ID> (2,627)
359332852

>  <transfer_container_id> (2,627)
PTN000000067

>  <COMPOUND_NUMBER> (2,627)
WAY-334319

>  <BAR_CODE_NO> (2,627)
309320

>  <LOCATION_CODE> (2,627)
PTNCS

>  <AMOUNT_CURRENT> (2,627)
32.5

$$$$
WAY-334321
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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  5  4  1  0  0  0  0
  6  8  1  0  0  0  0
  7  1  2  0  0  0  0
  8  7  1  0  0  0  0
  9  5  1  0  0  0  0
 10  5  1  0  0  0  0
 11  3  1  0  0  0  0
 12  2  2  0  0  0  0
 13  4  2  0  0  0  0
 14  9  2  0  0  0  0
 15  6  2  0  0  0  0
 16 10  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  2  0  0  0  0
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 20 17  2  0  0  0  0
 21 18  1  0  0  0  0
 22  9  1  0  0  0  0
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  3  6  1  0  0  0  0
 16 14  1  0  0  0  0
 20 19  1  0  0  0  0
 28 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,628)
2628

>  <Formula> (2,628)
C21H19N3O4

>  <MolWeight> (2,628)
377.39326

>  <PCAT_CMPD_ID> (2,628)
WAY-334321

>  <CNC_ID> (2,628)
359332854

>  <transfer_container_id> (2,628)
PTN000000067

>  <COMPOUND_NUMBER> (2,628)
WAY-334321

>  <BAR_CODE_NO> (2,628)
309322

>  <LOCATION_CODE> (2,628)
PTNCS

>  <AMOUNT_CURRENT> (2,628)
32.5

$$$$
WAY-334328
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  9  5  1  0  0  0  0
 10  6  2  0  0  0  0
 11 12  1  0  0  0  0
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 13  2  2  0  0  0  0
 14 10  1  0  0  0  0
 15 24  1  0  0  0  0
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 17  4  2  0  0  0  0
 18  5  2  0  0  0  0
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  7  3  2  0  0  0  0
 21 14  2  0  0  0  0
 11 15  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,629)
2629

>  <Formula> (2,629)
C21H19N3O5

>  <MolWeight> (2,629)
393.39266

>  <PCAT_CMPD_ID> (2,629)
WAY-334328

>  <CNC_ID> (2,629)
359332861

>  <transfer_container_id> (2,629)
PTN000000067

>  <COMPOUND_NUMBER> (2,629)
WAY-334328

>  <BAR_CODE_NO> (2,629)
309329

>  <LOCATION_CODE> (2,629)
PTNCS

>  <AMOUNT_CURRENT> (2,629)
32.5

$$$$
WAY-333165
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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 10 17  1  0  0  0  0
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 10  1  0  0  0  0
 14 13  2  0  0  0  0
 15  5  2  0  0  0  0
 16  7  2  0  0  0  0
 17 21  1  0  0  0  0
 18 20  1  0  0  0  0
 19  4  1  0  0  0  0
 20 12  1  0  0  0  0
 21 12  1  0  0  0  0
 22  9  1  0  0  0  0
 23 14  1  0  0  0  0
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 25 29  1  0  0  0  0
 26 22  1  0  0  0  0
 27 13  1  0  0  0  0
 28 27  2  0  0  0  0
 29 26  1  0  0  0  0
 30 28  1  0  0  0  0
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 32 25  2  0  0  0  0
 33 31  2  0  0  0  0
 34 32  1  0  0  0  0
 35 34  2  0  0  0  0
  8  9  1  0  0  0  0
  7  6  1  0  0  0  0
 10 18  1  0  0  0  0
 33 35  1  0  0  0  0
 30 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,630)
2630

>  <Formula> (2,630)
C26H29ClN6O2

>  <MolWeight> (2,630)
493.00046

>  <PCAT_CMPD_ID> (2,630)
WAY-333165

>  <CNC_ID> (2,630)
359331700

>  <transfer_container_id> (2,630)
PTN000000067

>  <COMPOUND_NUMBER> (2,630)
WAY-333165

>  <BAR_CODE_NO> (2,630)
308166

>  <LOCATION_CODE> (2,630)
PTNCS

>  <AMOUNT_CURRENT> (2,630)
32.5

$$$$
WAY-331238
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   -6.9208    4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9375    7.3167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  7  1  1  0  0  0  0
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  9  2  1  0  0  0  0
 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  5  2  0  0  0  0
 13  6  2  0  0  0  0
 14  3  1  0  0  0  0
 15  4  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  1  0  0  0  0
 18  9  1  0  0  0  0
 19 20  1  0  0  0  0
 20 23  1  0  0  0  0
 21 19  1  0  0  0  0
 22 16  1  0  0  0  0
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 25 18  1  0  0  0  0
 26 21  2  0  0  0  0
 27 21  1  0  0  0  0
 28 24  1  0  0  0  0
 29 27  2  0  0  0  0
 30 26  1  0  0  0  0
 31 29  1  0  0  0  0
  9  8  1  0  0  0  0
  4  6  1  0  0  0  0
 20 22  1  0  0  0  0
 31 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,631)
2631

>  <Formula> (2,631)
C23H31N5O3

>  <MolWeight> (2,631)
425.52394

>  <PCAT_CMPD_ID> (2,631)
WAY-331238

>  <CNC_ID> (2,631)
359318593

>  <transfer_container_id> (2,631)
PTN000000065

>  <COMPOUND_NUMBER> (2,631)
WAY-331238

>  <BAR_CODE_NO> (2,631)
306239

>  <LOCATION_CODE> (2,631)
PTNCS

>  <AMOUNT_CURRENT> (2,631)
32.5

$$$$
WAY-331217
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
   -6.7667    7.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7542    4.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
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 10  4  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  6  2  0  0  0  0
 14  7  2  0  0  0  0
 15 12  1  0  0  0  0
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 18  3  1  0  0  0  0
 19  5  1  0  0  0  0
 20 16  1  0  0  0  0
 21 15  1  0  0  0  0
 22 17  2  0  0  0  0
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 25 15  1  0  0  0  0
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 29 24  1  0  0  0  0
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 31 28  1  0  0  0  0
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  9  8  2  0  0  0  0
  6  3  1  0  0  0  0
 23 20  2  0  0  0  0
 32 31  2  0  0  0  0
M  END
>  <Mol_ID> (2,632)
2632

>  <Formula> (2,632)
C25H29N5O2

>  <MolWeight> (2,632)
431.53006

>  <PCAT_CMPD_ID> (2,632)
WAY-331217

>  <CNC_ID> (2,632)
359318572

>  <transfer_container_id> (2,632)
PTN000000065

>  <COMPOUND_NUMBER> (2,632)
WAY-331217

>  <BAR_CODE_NO> (2,632)
306218

>  <LOCATION_CODE> (2,632)
PTNCS

>  <AMOUNT_CURRENT> (2,632)
32.5

$$$$
WAY-334045
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.0292    2.4250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3125    3.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  4  2  0  0  0  0
  3  1  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  6  2  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  3  2  0  0  0  0
 14  5  1  0  0  0  0
 15  8  1  0  0  0  0
 16 14  2  0  0  0  0
 17 13  1  0  0  0  0
 18 10  2  0  0  0  0
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 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
 18 19  1  0  0  0  0
  2  5  1  0  0  0  0
  9 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,633)
2633

>  <Formula> (2,633)
C14H15N3O4S2

>  <MolWeight> (2,633)
353.4166

>  <PCAT_CMPD_ID> (2,633)
WAY-334045

>  <CNC_ID> (2,633)
359332578

>  <transfer_container_id> (2,633)
PTN000000067

>  <COMPOUND_NUMBER> (2,633)
WAY-334045

>  <BAR_CODE_NO> (2,633)
309046

>  <LOCATION_CODE> (2,633)
PTNCS

>  <AMOUNT_CURRENT> (2,633)
32.5

$$$$
WAY-334053
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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    4.5000    2.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2250    1.9708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  9  2  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  4  1  0  0  0  0
 10  2  2  0  0  0  0
 11  5  1  0  0  0  0
 12 13  2  0  0  0  0
 13  8  1  0  0  0  0
 14 16  1  0  0  0  0
 15 14  2  0  0  0  0
 16  5  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  2  0  0  0  0
 19 18  1  0  0  0  0
 20 17  2  0  0  0  0
 21 19  2  0  0  0  0
  4  8  2  0  0  0  0
  6 12  1  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,634)
2634

>  <Formula> (2,634)
C16H13N3OS

>  <MolWeight> (2,634)
295.35892

>  <PCAT_CMPD_ID> (2,634)
WAY-334053

>  <CNC_ID> (2,634)
359332586

>  <transfer_container_id> (2,634)
PTN000000067

>  <COMPOUND_NUMBER> (2,634)
WAY-334053

>  <BAR_CODE_NO> (2,634)
309054

>  <LOCATION_CODE> (2,634)
PTNCS

>  <AMOUNT_CURRENT> (2,634)
32.5

$$$$
WAY-334059
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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    0.0000    6.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  1  0  0  0  0
 11  6  2  0  0  0  0
 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  1  0  0  0  0
 17  4  2  0  0  0  0
 18  5  2  0  0  0  0
 19 17  1  0  0  0  0
 20 19  2  0  0  0  0
  5  3  1  0  0  0  0
 14 16  2  0  0  0  0
 20 18  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,635)
2635

>  <Formula> (2,635)
C16H12N2O2

>  <MolWeight> (2,635)
264.27868

>  <PCAT_CMPD_ID> (2,635)
WAY-334059

>  <CNC_ID> (2,635)
359332592

>  <transfer_container_id> (2,635)
PTN000000067

>  <COMPOUND_NUMBER> (2,635)
WAY-334059

>  <BAR_CODE_NO> (2,635)
309060

>  <LOCATION_CODE> (2,635)
PTNCS

>  <AMOUNT_CURRENT> (2,635)
32.5

$$$$
WAY-334066
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    7.2667   -9.7167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0000   -9.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  2  0  0  0  0
  6  8  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  6  1  0  0  0  0
 10  3  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  2  0  0  0  0
 13  7  1  0  0  0  0
 14  9  2  0  0  0  0
 15  9  1  0  0  0  0
 16 10  1  0  0  0  0
 17 16  1  0  0  0  0
 18 12  1  0  0  0  0
 19 13  2  0  0  0  0
 20 14  1  0  0  0  0
 21 15  2  0  0  0  0
 22 19  1  0  0  0  0
 23 21  1  0  0  0  0
 22 18  2  0  0  0  0
 11 17  1  0  0  0  0
 23 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,636)
2636

>  <Formula> (2,636)
C18H22N2O2S

>  <MolWeight> (2,636)
330.44448

>  <PCAT_CMPD_ID> (2,636)
WAY-334066

>  <CNC_ID> (2,636)
359332599

>  <transfer_container_id> (2,636)
PTN000000067

>  <COMPOUND_NUMBER> (2,636)
WAY-334066

>  <BAR_CODE_NO> (2,636)
309067

>  <LOCATION_CODE> (2,636)
PTNCS

>  <AMOUNT_CURRENT> (2,636)
32.5

$$$$
WAY-334098
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  9  1  0  0  0  0
  8  7  1  0  0  0  0
  9 17  1  0  0  0  0
 10  8  2  0  0  0  0
 11  2  1  0  0  0  0
 12 10  1  0  0  0  0
 13 14  1  0  0  0  0
 14  6  2  0  0  0  0
 15 19  1  0  0  0  0
 16  7  2  0  0  0  0
 17  4  1  0  0  0  0
 18  8  1  0  0  0  0
 19 18  2  0  0  0  0
 20 12  1  0  0  0  0
 21 15  1  0  0  0  0
 22  6  1  0  0  0  0
 23 20  1  0  0  0  0
 24 21  1  0  0  0  0
  5  4  2  0  0  0  0
 11 13  2  0  0  0  0
 12 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,637)
2637

>  <Formula> (2,637)
C18H19N3O3

>  <MolWeight> (2,637)
325.36176

>  <PCAT_CMPD_ID> (2,637)
WAY-334098

>  <CNC_ID> (2,637)
359332631

>  <transfer_container_id> (2,637)
PTN000000067

>  <COMPOUND_NUMBER> (2,637)
WAY-334098

>  <BAR_CODE_NO> (2,637)
309099

>  <LOCATION_CODE> (2,637)
PTNCS

>  <AMOUNT_CURRENT> (2,637)
32.5

$$$$
WAY-334105
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
  8 14  1  0  0  0  0
  9  1  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12  7  2  0  0  0  0
 13  7  1  0  0  0  0
 14 19  1  0  0  0  0
 15  2  1  0  0  0  0
 16 17  1  0  0  0  0
 17  9  2  0  0  0  0
 18  8  2  0  0  0  0
 19  4  1  0  0  0  0
 20  6  1  0  0  0  0
 21 10  1  0  0  0  0
 22 11  1  0  0  0  0
 23  9  1  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
  5  4  2  0  0  0  0
 15 16  2  0  0  0  0
  6 10  2  0  0  0  0
M  END
>  <Mol_ID> (2,638)
2638

>  <Formula> (2,638)
C19H21N3O4

>  <MolWeight> (2,638)
355.38774

>  <PCAT_CMPD_ID> (2,638)
WAY-334105

>  <CNC_ID> (2,638)
359332638

>  <transfer_container_id> (2,638)
PTN000000067

>  <COMPOUND_NUMBER> (2,638)
WAY-334105

>  <BAR_CODE_NO> (2,638)
309106

>  <LOCATION_CODE> (2,638)
PTNCS

>  <AMOUNT_CURRENT> (2,638)
32.5

$$$$
WAY-334193
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -2.3833    5.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  2  1  0  0  0  0
 12 15  2  0  0  0  0
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 14  8  2  0  0  0  0
 15  8  1  0  0  0  0
 16 12  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  1  0  0  0  0
 19 13  1  0  0  0  0
 20 12  1  0  0  0  0
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 22 17  1  0  0  0  0
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  6  4  1  0  0  0  0
 23 22  1  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,639)
2639

>  <Formula> (2,639)
C18H23N3O2

>  <MolWeight> (2,639)
313.39412

>  <PCAT_CMPD_ID> (2,639)
WAY-334193

>  <CNC_ID> (2,639)
359332726

>  <transfer_container_id> (2,639)
PTN000000067

>  <COMPOUND_NUMBER> (2,639)
WAY-334193

>  <BAR_CODE_NO> (2,639)
309194

>  <LOCATION_CODE> (2,639)
PTNCS

>  <AMOUNT_CURRENT> (2,639)
32.5

$$$$
WAY-334195
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  9  1  0  0  0  0
 12  4  2  0  0  0  0
 13  2  1  0  0  0  0
 14  8  1  0  0  0  0
 15 16  1  0  0  0  0
 16 14  2  0  0  0  0
 17  9  1  0  0  0  0
 18 15  1  0  0  0  0
 19 13  1  0  0  0  0
 20 13  1  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 20  1  0  0  0  0
 24 19  1  0  0  0  0
 25 23  1  0  0  0  0
  6  4  1  0  0  0  0
 25 24  1  0  0  0  0
 11 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,640)
2640

>  <Formula> (2,640)
C18H23N3O4

>  <MolWeight> (2,640)
345.39292

>  <PCAT_CMPD_ID> (2,640)
WAY-334195

>  <CNC_ID> (2,640)
359332728

>  <transfer_container_id> (2,640)
PTN000000067

>  <COMPOUND_NUMBER> (2,640)
WAY-334195

>  <BAR_CODE_NO> (2,640)
309196

>  <LOCATION_CODE> (2,640)
PTNCS

>  <AMOUNT_CURRENT> (2,640)
32.5

$$$$
WAY-334215
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  5  6  1  0  0  0  0
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  8  1  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  8  1  0  0  0  0
 12  2  1  0  0  0  0
 13  3  2  0  0  0  0
 14 16  2  0  0  0  0
 15  3  1  0  0  0  0
 16  7  1  0  0  0  0
 17  7  2  0  0  0  0
 18 23  2  0  0  0  0
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 27 21  1  0  0  0  0
 28 24  2  0  0  0  0
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  2 11  1  0  0  0  0
 18 14  1  0  0  0  0
 28 25  1  0  0  0  0
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M  END
>  <Mol_ID> (2,641)
2641

>  <Formula> (2,641)
C24H32N4O

>  <MolWeight> (2,641)
392.53708

>  <PCAT_CMPD_ID> (2,641)
WAY-334215

>  <CNC_ID> (2,641)
359332748

>  <transfer_container_id> (2,641)
PTN000000067

>  <COMPOUND_NUMBER> (2,641)
WAY-334215

>  <BAR_CODE_NO> (2,641)
309216

>  <LOCATION_CODE> (2,641)
PTNCS

>  <AMOUNT_CURRENT> (2,641)
32.5

$$$$
WAY-334402
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 10  6  1  0  0  0  0
 11 10  1  0  0  0  0
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 13  5  1  0  0  0  0
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 15  7  2  0  0  0  0
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 17 10  2  0  0  0  0
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  9  6  2  0  0  0  0
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 14 16  2  0  0  0  0
 12 22  1  0  0  0  0
 29 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,642)
2642

>  <Formula> (2,642)
C23H23N5O2

>  <MolWeight> (2,642)
401.46102

>  <PCAT_CMPD_ID> (2,642)
WAY-334402

>  <CNC_ID> (2,642)
359332935

>  <transfer_container_id> (2,642)
PTN000000067

>  <COMPOUND_NUMBER> (2,642)
WAY-334402

>  <BAR_CODE_NO> (2,642)
309403

>  <LOCATION_CODE> (2,642)
PTNCS

>  <AMOUNT_CURRENT> (2,642)
32.5

$$$$
WAY-334518
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  3  2  0  0  0  0
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 14  7  1  0  0  0  0
 15 13  1  0  0  0  0
 16  9  1  0  0  0  0
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 20 15  1  0  0  0  0
 21 14  2  0  0  0  0
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  7  9  2  0  0  0  0
  6  8  2  0  0  0  0
 22 21  1  0  0  0  0
 15 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,643)
2643

>  <Formula> (2,643)
C18H14N2O2

>  <MolWeight> (2,643)
290.31596

>  <PCAT_CMPD_ID> (2,643)
WAY-334518

>  <CNC_ID> (2,643)
359333050

>  <transfer_container_id> (2,643)
PTN000000067

>  <COMPOUND_NUMBER> (2,643)
WAY-334518

>  <BAR_CODE_NO> (2,643)
309519

>  <LOCATION_CODE> (2,643)
PTNCS

>  <AMOUNT_CURRENT> (2,643)
32.5

$$$$
WAY-334519
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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 10  4  1  0  0  0  0
 11 10  1  0  0  0  0
 12  3  2  0  0  0  0
 13 11  2  0  0  0  0
 14 13  1  0  0  0  0
 15  7  1  0  0  0  0
 16  9  1  0  0  0  0
 17 11  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  2  0  0  0  0
 20 17  2  0  0  0  0
 21 16  2  0  0  0  0
 22 20  1  0  0  0  0
  7  9  2  0  0  0  0
  6  8  2  0  0  0  0
 21 19  1  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,644)
2644

>  <Formula> (2,644)
C17H11ClN2O2

>  <MolWeight> (2,644)
310.73444

>  <PCAT_CMPD_ID> (2,644)
WAY-334519

>  <CNC_ID> (2,644)
359333051

>  <transfer_container_id> (2,644)
PTN000000067

>  <COMPOUND_NUMBER> (2,644)
WAY-334519

>  <BAR_CODE_NO> (2,644)
309520

>  <LOCATION_CODE> (2,644)
PTNCS

>  <AMOUNT_CURRENT> (2,644)
32.5

$$$$
WAY-334579
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.6000  -10.7167    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  8  1  0  0  0  0
  6 18  1  0  0  0  0
  7  6  1  0  0  0  0
  8 15  2  0  0  0  0
  9  4  2  0  0  0  0
 10  2  2  0  0  0  0
 11  5  1  0  0  0  0
 12  9  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15 10  1  0  0  0  0
 16  3  1  0  0  0  0
 17  3  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20  7  2  0  0  0  0
 21 11  2  0  0  0  0
 22 12  1  0  0  0  0
 23  7  1  0  0  0  0
 24 10  1  0  0  0  0
 25 23  1  0  0  0  0
 26 25  1  0  0  0  0
  6 19  1  0  0  0  0
  8  9  1  0  0  0  0
 11 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,645)
2645

>  <Formula> (2,645)
C16H21N3O6S

>  <MolWeight> (2,645)
383.41944

>  <PCAT_CMPD_ID> (2,645)
WAY-334579

>  <CNC_ID> (2,645)
359333111

>  <transfer_container_id> (2,645)
PTN000000067

>  <COMPOUND_NUMBER> (2,645)
WAY-334579

>  <BAR_CODE_NO> (2,645)
309580

>  <LOCATION_CODE> (2,645)
PTNCS

>  <AMOUNT_CURRENT> (2,645)
32.5

$$$$
WAY-334598
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
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  6  1  2  0  0  0  0
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 10  9  1  0  0  0  0
 11  5  1  0  0  0  0
 12  5  2  0  0  0  0
 13  8  2  0  0  0  0
 14  8  1  0  0  0  0
 15 19  1  0  0  0  0
 16 18  2  0  0  0  0
 17 13  1  0  0  0  0
 18 12  1  0  0  0  0
 19 14  2  0  0  0  0
 20 11  2  0  0  0  0
 21 15  1  0  0  0  0
 22 16  1  0  0  0  0
 23 10  2  0  0  0  0
 24  9  2  0  0  0  0
 25 26  2  0  0  0  0
 26 24  1  0  0  0  0
 20 16  1  0  0  0  0
 17 15  2  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,646)
2646

>  <Formula> (2,646)
C18H13Cl2N3O2S

>  <MolWeight> (2,646)
406.28572

>  <PCAT_CMPD_ID> (2,646)
WAY-334598

>  <CNC_ID> (2,646)
359333130

>  <transfer_container_id> (2,646)
PTN000000067

>  <COMPOUND_NUMBER> (2,646)
WAY-334598

>  <BAR_CODE_NO> (2,646)
309599

>  <LOCATION_CODE> (2,646)
PTNCS

>  <AMOUNT_CURRENT> (2,646)
32.5

$$$$
WAY-334609
csChFnd80/10111816222D

 33 36  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  6  5  1  0  0  0  0
 25 21  2  0  0  0  0
 24 20  2  0  0  0  0
 22 32  2  0  0  0  0
M  END
>  <Mol_ID> (2,647)
2647

>  <Formula> (2,647)
C24H18F2N4O2S

>  <MolWeight> (2,647)
464.4871264

>  <PCAT_CMPD_ID> (2,647)
WAY-334609

>  <CNC_ID> (2,647)
359333140

>  <transfer_container_id> (2,647)
PTN000000067

>  <COMPOUND_NUMBER> (2,647)
WAY-334609

>  <BAR_CODE_NO> (2,647)
309610

>  <LOCATION_CODE> (2,647)
PTNCS

>  <AMOUNT_CURRENT> (2,647)
32.5

$$$$
WAY-334614
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  8 10  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,648)
2648

>  <Formula> (2,648)
C13H7ClN2O3S

>  <MolWeight> (2,648)
306.72428

>  <PCAT_CMPD_ID> (2,648)
WAY-334614

>  <CNC_ID> (2,648)
359333145

>  <transfer_container_id> (2,648)
PTN000000067

>  <COMPOUND_NUMBER> (2,648)
WAY-334614

>  <BAR_CODE_NO> (2,648)
309615

>  <LOCATION_CODE> (2,648)
PTNCS

>  <AMOUNT_CURRENT> (2,648)
32.5

$$$$
WAY-334616
csChFnd80/10111816222D

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 15  8  2  0  0  0  0
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 18  9  2  0  0  0  0
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  4  8  1  0  0  0  0
 20 15  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,649)
2649

>  <Formula> (2,649)
C15H12N2O4S

>  <MolWeight> (2,649)
316.33178

>  <PCAT_CMPD_ID> (2,649)
WAY-334616

>  <CNC_ID> (2,649)
359333147

>  <transfer_container_id> (2,649)
PTN000000067

>  <COMPOUND_NUMBER> (2,649)
WAY-334616

>  <BAR_CODE_NO> (2,649)
309617

>  <LOCATION_CODE> (2,649)
PTNCS

>  <AMOUNT_CURRENT> (2,649)
32.5

$$$$
WAY-334620
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  8 17  1  0  0  0  0
 30 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,650)
2650

>  <Formula> (2,650)
C22H24N4O4

>  <MolWeight> (2,650)
408.45036

>  <PCAT_CMPD_ID> (2,650)
WAY-334620

>  <CNC_ID> (2,650)
359333151

>  <transfer_container_id> (2,650)
PTN000000067

>  <COMPOUND_NUMBER> (2,650)
WAY-334620

>  <BAR_CODE_NO> (2,650)
309621

>  <LOCATION_CODE> (2,650)
PTNCS

>  <AMOUNT_CURRENT> (2,650)
32.5

$$$$
WAY-334633
csChFnd80/10111816222D

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 14  7  1  0  0  0  0
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M  END
>  <Mol_ID> (2,651)
2651

>  <Formula> (2,651)
C25H30N4O3

>  <MolWeight> (2,651)
434.5307

>  <PCAT_CMPD_ID> (2,651)
WAY-334633

>  <CNC_ID> (2,651)
359333164

>  <transfer_container_id> (2,651)
PTN000000067

>  <COMPOUND_NUMBER> (2,651)
WAY-334633

>  <BAR_CODE_NO> (2,651)
309634

>  <LOCATION_CODE> (2,651)
PTNCS

>  <AMOUNT_CURRENT> (2,651)
32.5

$$$$
WAY-334671
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 18 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,652)
2652

>  <Formula> (2,652)
C18H10ClNO2S

>  <MolWeight> (2,652)
339.7955

>  <PCAT_CMPD_ID> (2,652)
WAY-334671

>  <CNC_ID> (2,652)
359333201

>  <transfer_container_id> (2,652)
PTN000000067

>  <COMPOUND_NUMBER> (2,652)
WAY-334671

>  <BAR_CODE_NO> (2,652)
309672

>  <LOCATION_CODE> (2,652)
PTNCS

>  <AMOUNT_CURRENT> (2,652)
32.5

$$$$
WAY-334678
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,653)
2653

>  <Formula> (2,653)
C15H8Cl2N4O2S

>  <MolWeight> (2,653)
379.22062

>  <PCAT_CMPD_ID> (2,653)
WAY-334678

>  <CNC_ID> (2,653)
359333208

>  <transfer_container_id> (2,653)
PTN000000067

>  <COMPOUND_NUMBER> (2,653)
WAY-334678

>  <BAR_CODE_NO> (2,653)
309679

>  <LOCATION_CODE> (2,653)
PTNCS

>  <AMOUNT_CURRENT> (2,653)
32.5

$$$$
WAY-334680
csChFnd80/10111816222D

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 13  8  1  0  0  0  0
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 16 10  2  0  0  0  0
 17 16  1  0  0  0  0
 18 11  1  0  0  0  0
 19  9  1  0  0  0  0
 20 14  1  0  0  0  0
 21  9  2  0  0  0  0
 22 23  2  0  0  0  0
 23 21  1  0  0  0  0
  5  6  1  0  0  0  0
 13  7  1  0  0  0  0
 15 22  1  0  0  0  0
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M  END
>  <Mol_ID> (2,654)
2654

>  <Formula> (2,654)
C15H9Cl2N5S

>  <MolWeight> (2,654)
362.23646

>  <PCAT_CMPD_ID> (2,654)
WAY-334680

>  <CNC_ID> (2,654)
359333210

>  <transfer_container_id> (2,654)
PTN000000067

>  <COMPOUND_NUMBER> (2,654)
WAY-334680

>  <BAR_CODE_NO> (2,654)
309681

>  <LOCATION_CODE> (2,654)
PTNCS

>  <AMOUNT_CURRENT> (2,654)
32.5

$$$$
WAY-334681-A
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 15  9  1  0  0  0  0
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 17 14  2  0  0  0  0
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 19  9  2  0  0  0  0
 20 16  1  0  0  0  0
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 22 20  1  0  0  0  0
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 24 22  1  0  0  0  0
  6  5  1  0  0  0  0
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 21 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,655)
2655

>  <Formula> (2,655)
C17H15N5OS

>  <MolWeight> (2,655)
337.3989

>  <PCAT_CMPD_ID> (2,655)
WAY-334681-A

>  <CNC_ID> (2,655)
359333211

>  <transfer_container_id> (2,655)
PTN000000067

>  <COMPOUND_NUMBER> (2,655)
WAY-334681-A

>  <BAR_CODE_NO> (2,655)
309682

>  <LOCATION_CODE> (2,655)
PTNCS

>  <AMOUNT_CURRENT> (2,655)
32.5

$$$$
WAY-334719
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,656)
2656

>  <Formula> (2,656)
C24H20N4O3S

>  <MolWeight> (2,656)
444.5056

>  <PCAT_CMPD_ID> (2,656)
WAY-334719

>  <CNC_ID> (2,656)
359333249

>  <transfer_container_id> (2,656)
PTN000000067

>  <COMPOUND_NUMBER> (2,656)
WAY-334719

>  <BAR_CODE_NO> (2,656)
309720

>  <LOCATION_CODE> (2,656)
PTNCS

>  <AMOUNT_CURRENT> (2,656)
32.5

$$$$
WAY-334961
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
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 14 10  1  0  0  0  0
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 30 25  2  0  0  0  0
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M  END
>  <Mol_ID> (2,657)
2657

>  <Formula> (2,657)
C27H27NO7

>  <MolWeight> (2,657)
477.50578

>  <PCAT_CMPD_ID> (2,657)
WAY-334961

>  <CNC_ID> (2,657)
359333491

>  <transfer_container_id> (2,657)
PTN000000067

>  <COMPOUND_NUMBER> (2,657)
WAY-334961

>  <BAR_CODE_NO> (2,657)
309962

>  <LOCATION_CODE> (2,657)
PTNCS

>  <AMOUNT_CURRENT> (2,657)
32.5

$$$$
WAY-334982
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  7  2  0  0  0  0
 12 20  2  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
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 18  8  2  0  0  0  0
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 20 22  1  0  0  0  0
 21  5  1  0  0  0  0
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 26  6  1  0  0  0  0
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 25 23  2  0  0  0  0
 29 28  1  0  0  0  0
 12  9  1  0  0  0  0
 15 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,658)
2658

>  <Formula> (2,658)
C24H18N2O3

>  <MolWeight> (2,658)
382.41132

>  <PCAT_CMPD_ID> (2,658)
WAY-334982

>  <CNC_ID> (2,658)
359333512

>  <transfer_container_id> (2,658)
PTN000000067

>  <COMPOUND_NUMBER> (2,658)
WAY-334982

>  <BAR_CODE_NO> (2,658)
309983

>  <LOCATION_CODE> (2,658)
PTNCS

>  <AMOUNT_CURRENT> (2,658)
32.5

$$$$
WAY-334994
csChFnd80/10111816222D

 35 39  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
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M  END
>  <Mol_ID> (2,659)
2659

>  <Formula> (2,659)
C25H23N5O5

>  <MolWeight> (2,659)
473.48062

>  <PCAT_CMPD_ID> (2,659)
WAY-334994

>  <CNC_ID> (2,659)
359333524

>  <transfer_container_id> (2,659)
PTN000000067

>  <COMPOUND_NUMBER> (2,659)
WAY-334994

>  <BAR_CODE_NO> (2,659)
309995

>  <LOCATION_CODE> (2,659)
PTNCS

>  <AMOUNT_CURRENT> (2,659)
32.5

$$$$
WAY-335038
csChFnd80/10111816222D

 15 16  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11  2  1  0  0  0  0
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 14  7  1  0  0  0  0
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  9 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,660)
2660

>  <Formula> (2,660)
C12H16N2O

>  <MolWeight> (2,660)
204.26824

>  <PCAT_CMPD_ID> (2,660)
WAY-335038

>  <CNC_ID> (2,660)
359333568

>  <transfer_container_id> (2,660)
PTN000000067

>  <COMPOUND_NUMBER> (2,660)
WAY-335038

>  <BAR_CODE_NO> (2,660)
310039

>  <LOCATION_CODE> (2,660)
PTNCS

>  <AMOUNT_CURRENT> (2,660)
32.5

$$$$
WAY-335039
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,661)
2661

>  <Formula> (2,661)
C13H16N2O3

>  <MolWeight> (2,661)
248.27774

>  <PCAT_CMPD_ID> (2,661)
WAY-335039

>  <CNC_ID> (2,661)
359333569

>  <transfer_container_id> (2,661)
PTN000000067

>  <COMPOUND_NUMBER> (2,661)
WAY-335039

>  <BAR_CODE_NO> (2,661)
310040

>  <LOCATION_CODE> (2,661)
PTNCS

>  <AMOUNT_CURRENT> (2,661)
32.5

$$$$
WAY-335051
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  1  2  0  0  0  0
  6  4  1  0  0  0  0
  7 14  2  0  0  0  0
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 10  7  1  0  0  0  0
 11  6  1  0  0  0  0
 12  6  2  0  0  0  0
 13 11  2  0  0  0  0
 14 12  1  0  0  0  0
  8  9  1  0  0  0  0
 13  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,662)
2662

>  <Formula> (2,662)
C10H11FN2O

>  <MolWeight> (2,662)
194.2055432

>  <PCAT_CMPD_ID> (2,662)
WAY-335051

>  <CNC_ID> (2,662)
359333580

>  <transfer_container_id> (2,662)
PTN000000067

>  <COMPOUND_NUMBER> (2,662)
WAY-335051

>  <BAR_CODE_NO> (2,662)
310052

>  <LOCATION_CODE> (2,662)
PTNCS

>  <AMOUNT_CURRENT> (2,662)
32.5

$$$$
WAY-335057
csChFnd80/10111816222D

 14 15  0  0  0  0  0  0  0  0999 V2000
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  8  2  1  0  0  0  0
  9  3  1  0  0  0  0
 10  7  1  0  0  0  0
 11  6  1  0  0  0  0
 12  6  2  0  0  0  0
 13 11  2  0  0  0  0
 14 12  1  0  0  0  0
  8  9  1  0  0  0  0
 13  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,663)
2663

>  <Formula> (2,663)
C10H11ClN2O

>  <MolWeight> (2,663)
210.66014

>  <PCAT_CMPD_ID> (2,663)
WAY-335057

>  <CNC_ID> (2,663)
359333586

>  <transfer_container_id> (2,663)
PTN000000067

>  <COMPOUND_NUMBER> (2,663)
WAY-335057

>  <BAR_CODE_NO> (2,663)
310058

>  <LOCATION_CODE> (2,663)
PTNCS

>  <AMOUNT_CURRENT> (2,663)
32.5

$$$$
WAY-335072
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
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  6  7  1  0  0  0  0
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  8 16  2  0  0  0  0
  9  1  1  0  0  0  0
 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  2  0  0  0  0
 13  1  2  0  0  0  0
 14  3  1  0  0  0  0
 15  3  1  0  0  0  0
 16 18  1  0  0  0  0
 17  5  2  0  0  0  0
 18  9  2  0  0  0  0
 19 11  2  0  0  0  0
 20 14  1  0  0  0  0
 21 15  1  0  0  0  0
 22 21  1  0  0  0  0
 23 11  1  0  0  0  0
 24  7  1  0  0  0  0
 25 21  1  0  0  0  0
 26 20  1  0  0  0  0
 27 23  1  0  0  0  0
 28 24  1  0  0  0  0
 29 27  1  0  0  0  0
  4  8  1  0  0  0  0
 20 22  1  0  0  0  0
  6  2  2  0  0  0  0
M  END
>  <Mol_ID> (2,664)
2664

>  <Formula> (2,664)
C21H28N2O5S

>  <MolWeight> (2,664)
420.52242

>  <PCAT_CMPD_ID> (2,664)
WAY-335072

>  <CNC_ID> (2,664)
359333601

>  <transfer_container_id> (2,664)
PTN000000067

>  <COMPOUND_NUMBER> (2,664)
WAY-335072

>  <BAR_CODE_NO> (2,664)
310073

>  <LOCATION_CODE> (2,664)
PTNCS

>  <AMOUNT_CURRENT> (2,664)
32.5

$$$$
WAY-335084
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  7  2  0  0  0  0
 13  6  2  0  0  0  0
 14  7  1  0  0  0  0
 15  6  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  1  0  0  0  0
 18 15  2  0  0  0  0
 19 18  1  0  0  0  0
 17 19  2  0  0  0  0
  8  3  2  0  0  0  0
M  END
>  <Mol_ID> (2,665)
2665

>  <Formula> (2,665)
C13H12O5S

>  <MolWeight> (2,665)
280.29638

>  <PCAT_CMPD_ID> (2,665)
WAY-335084

>  <CNC_ID> (2,665)
359333611

>  <transfer_container_id> (2,665)
PTN000000067

>  <COMPOUND_NUMBER> (2,665)
WAY-335084

>  <BAR_CODE_NO> (2,665)
310085

>  <LOCATION_CODE> (2,665)
PTNCS

>  <AMOUNT_CURRENT> (2,665)
32.5

$$$$
WAY-335087
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  2  1  0  0  0  0
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 13  1  2  0  0  0  0
 14 16  1  0  0  0  0
 15  4  2  0  0  0  0
 16  9  2  0  0  0  0
 17  8  1  0  0  0  0
 18  8  1  0  0  0  0
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 21  6  1  0  0  0  0
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 25 20  1  0  0  0  0
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 28 25  1  0  0  0  0
  3  7  1  0  0  0  0
 23 24  1  0  0  0  0
  5  2  2  0  0  0  0
M  END
>  <Mol_ID> (2,666)
2666

>  <Formula> (2,666)
C20H26N2O5S

>  <MolWeight> (2,666)
406.49584

>  <PCAT_CMPD_ID> (2,666)
WAY-335087

>  <CNC_ID> (2,666)
359333614

>  <transfer_container_id> (2,666)
PTN000000067

>  <COMPOUND_NUMBER> (2,666)
WAY-335087

>  <BAR_CODE_NO> (2,666)
310088

>  <LOCATION_CODE> (2,666)
PTNCS

>  <AMOUNT_CURRENT> (2,666)
32.5

$$$$
WAY-335140
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 15  5  1  0  0  0  0
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 17  7  2  0  0  0  0
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  4 11  1  0  0  0  0
 22 23  1  0  0  0  0
  6  2  2  0  0  0  0
M  END
>  <Mol_ID> (2,667)
2667

>  <Formula> (2,667)
C21H29N3O4S

>  <MolWeight> (2,667)
419.53766

>  <PCAT_CMPD_ID> (2,667)
WAY-335140

>  <CNC_ID> (2,667)
359333667

>  <transfer_container_id> (2,667)
PTN000000067

>  <COMPOUND_NUMBER> (2,667)
WAY-335140

>  <BAR_CODE_NO> (2,667)
310141

>  <LOCATION_CODE> (2,667)
PTNCS

>  <AMOUNT_CURRENT> (2,667)
32.5

$$$$
WAY-335163
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 13  8  1  0  0  0  0
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 16  7  1  0  0  0  0
 17  3  2  0  0  0  0
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 21  9  1  0  0  0  0
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 23  5  1  0  0  0  0
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 26  9  1  0  0  0  0
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 20  6  1  0  0  0  0
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 14 15  1  0  0  0  0
 31 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,668)
2668

>  <Formula> (2,668)
C21H16ClFN2O5S

>  <MolWeight> (2,668)
462.8785432

>  <PCAT_CMPD_ID> (2,668)
WAY-335163

>  <CNC_ID> (2,668)
359333690

>  <transfer_container_id> (2,668)
PTN000000067

>  <COMPOUND_NUMBER> (2,668)
WAY-335163

>  <BAR_CODE_NO> (2,668)
310164

>  <LOCATION_CODE> (2,668)
PTNCS

>  <AMOUNT_CURRENT> (2,668)
32.5

$$$$
WAY-348739
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 10  1  0  0  0  0
 12  8  1  0  0  0  0
 13  7  2  0  0  0  0
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 16 14  2  0  0  0  0
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 18  5  2  0  0  0  0
 19  6  2  0  0  0  0
 20 22  1  0  0  0  0
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 26 19  1  0  0  0  0
 16 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,669)
2669

>  <Formula> (2,669)
C19H19BrN4O2

>  <MolWeight> (2,669)
415.28376

>  <PCAT_CMPD_ID> (2,669)
WAY-348739

>  <CNC_ID> (2,669)
359333725

>  <transfer_container_id> (2,669)
PTN000000067

>  <COMPOUND_NUMBER> (2,669)
WAY-348739

>  <BAR_CODE_NO> (2,669)
90461813

>  <LOCATION_CODE> (2,669)
PTNCS

>  <AMOUNT_CURRENT> (2,669)
32.1

$$$$
WAY-348770
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
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 14  5  2  0  0  0  0
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 17 18  1  0  0  0  0
 18  4  1  0  0  0  0
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 20  3  1  0  0  0  0
 21  9  1  0  0  0  0
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 25 23  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  1  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,670)
2670

>  <Formula> (2,670)
C19H19N3O2S

>  <MolWeight> (2,670)
353.43806

>  <PCAT_CMPD_ID> (2,670)
WAY-348770

>  <CNC_ID> (2,670)
359333726

>  <transfer_container_id> (2,670)
PTN000000067

>  <COMPOUND_NUMBER> (2,670)
WAY-348770

>  <BAR_CODE_NO> (2,670)
90461838

>  <LOCATION_CODE> (2,670)
PTNCS

>  <AMOUNT_CURRENT> (2,670)
32.9

$$$$
WAY-625061
csChFnd80/10111816222D

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 30 29  1  0  0  0  0
M  END
>  <Mol_ID> (2,671)
2671

>  <Formula> (2,671)
C21H23N3O5S

>  <MolWeight> (2,671)
429.48942

>  <PCAT_CMPD_ID> (2,671)
WAY-625061

>  <CNC_ID> (2,671)
359333870

>  <transfer_container_id> (2,671)
PTN000000067

>  <COMPOUND_NUMBER> (2,671)
WAY-625061

>  <BAR_CODE_NO> (2,671)
90459243

>  <LOCATION_CODE> (2,671)
PTNCS

>  <AMOUNT_CURRENT> (2,671)
33

$$$$
WAY-625109
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,672)
2672

>  <Formula> (2,672)
C25H25N5O4S

>  <MolWeight> (2,672)
491.5621

>  <PCAT_CMPD_ID> (2,672)
WAY-625109

>  <CNC_ID> (2,672)
359333918

>  <transfer_container_id> (2,672)
PTN000000067

>  <COMPOUND_NUMBER> (2,672)
WAY-625109

>  <BAR_CODE_NO> (2,672)
90459291

>  <LOCATION_CODE> (2,672)
PTNCS

>  <AMOUNT_CURRENT> (2,672)
32.4

$$$$
WAY-625138
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,673)
2673

>  <Formula> (2,673)
C21H30N2O5S

>  <MolWeight> (2,673)
422.5383

>  <PCAT_CMPD_ID> (2,673)
WAY-625138

>  <CNC_ID> (2,673)
359333947

>  <transfer_container_id> (2,673)
PTN000000067

>  <COMPOUND_NUMBER> (2,673)
WAY-625138

>  <BAR_CODE_NO> (2,673)
90459320

>  <LOCATION_CODE> (2,673)
PTNCS

>  <AMOUNT_CURRENT> (2,673)
32.6

$$$$
WAY-625182
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,674)
2674

>  <Formula> (2,674)
C23H28N2O5

>  <MolWeight> (2,674)
412.47882

>  <PCAT_CMPD_ID> (2,674)
WAY-625182

>  <CNC_ID> (2,674)
359333991

>  <transfer_container_id> (2,674)
PTN000000067

>  <COMPOUND_NUMBER> (2,674)
WAY-625182

>  <BAR_CODE_NO> (2,674)
90459367

>  <LOCATION_CODE> (2,674)
PTNCS

>  <AMOUNT_CURRENT> (2,674)
32.6

$$$$
WAY-625190
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,675)
2675

>  <Formula> (2,675)
C20H16N4O2S

>  <MolWeight> (2,675)
376.43164

>  <PCAT_CMPD_ID> (2,675)
WAY-625190

>  <CNC_ID> (2,675)
359333999

>  <transfer_container_id> (2,675)
PTN000000067

>  <COMPOUND_NUMBER> (2,675)
WAY-625190

>  <BAR_CODE_NO> (2,675)
90459375

>  <LOCATION_CODE> (2,675)
PTNCS

>  <AMOUNT_CURRENT> (2,675)
32.8

$$$$
WAY-625234
csChFnd80/10111816222D

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 19 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,676)
2676

>  <Formula> (2,676)
C19H15N3O7

>  <MolWeight> (2,676)
397.3383

>  <PCAT_CMPD_ID> (2,676)
WAY-625234

>  <CNC_ID> (2,676)
359334043

>  <transfer_container_id> (2,676)
PTN000000067

>  <COMPOUND_NUMBER> (2,676)
WAY-625234

>  <BAR_CODE_NO> (2,676)
90459419

>  <LOCATION_CODE> (2,676)
PTNCS

>  <AMOUNT_CURRENT> (2,676)
32.7

$$$$
WAY-625242
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 13 10  2  0  0  0  0
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M  END
>  <Mol_ID> (2,677)
2677

>  <Formula> (2,677)
C20H19N3O2

>  <MolWeight> (2,677)
333.38376

>  <PCAT_CMPD_ID> (2,677)
WAY-625242

>  <CNC_ID> (2,677)
359334051

>  <transfer_container_id> (2,677)
PTN000000067

>  <COMPOUND_NUMBER> (2,677)
WAY-625242

>  <BAR_CODE_NO> (2,677)
90459427

>  <LOCATION_CODE> (2,677)
PTNCS

>  <AMOUNT_CURRENT> (2,677)
32.2

$$$$
WAY-625249
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,678)
2678

>  <Formula> (2,678)
C23H25N3O5S2

>  <MolWeight> (2,678)
487.5917

>  <PCAT_CMPD_ID> (2,678)
WAY-625249

>  <CNC_ID> (2,678)
359334058

>  <transfer_container_id> (2,678)
PTN000000067

>  <COMPOUND_NUMBER> (2,678)
WAY-625249

>  <BAR_CODE_NO> (2,678)
90459434

>  <LOCATION_CODE> (2,678)
PTNCS

>  <AMOUNT_CURRENT> (2,678)
32.5

$$$$
WAY-625251
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,679)
2679

>  <Formula> (2,679)
C21H19N3O5

>  <MolWeight> (2,679)
393.39266

>  <PCAT_CMPD_ID> (2,679)
WAY-625251

>  <CNC_ID> (2,679)
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>  <transfer_container_id> (2,679)
PTN000000067

>  <COMPOUND_NUMBER> (2,679)
WAY-625251

>  <BAR_CODE_NO> (2,679)
90459437

>  <LOCATION_CODE> (2,679)
PTNCS

>  <AMOUNT_CURRENT> (2,679)
32.6

$$$$
WAY-625254
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,680)
2680

>  <Formula> (2,680)
C17H17Cl2N3O4

>  <MolWeight> (2,680)
398.24058

>  <PCAT_CMPD_ID> (2,680)
WAY-625254

>  <CNC_ID> (2,680)
359334063

>  <transfer_container_id> (2,680)
PTN000000067

>  <COMPOUND_NUMBER> (2,680)
WAY-625254

>  <BAR_CODE_NO> (2,680)
90459440

>  <LOCATION_CODE> (2,680)
PTNCS

>  <AMOUNT_CURRENT> (2,680)
32.3

$$$$
WAY-625277
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,681)
2681

>  <Formula> (2,681)
C10H9ClN2O2S2

>  <MolWeight> (2,681)
288.77366

>  <PCAT_CMPD_ID> (2,681)
WAY-625277

>  <CNC_ID> (2,681)
359334086

>  <transfer_container_id> (2,681)
PTN000000067

>  <COMPOUND_NUMBER> (2,681)
WAY-625277

>  <BAR_CODE_NO> (2,681)
90459463

>  <LOCATION_CODE> (2,681)
PTNCS

>  <AMOUNT_CURRENT> (2,681)
32.8

$$$$
WAY-625279-A
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,682)
2682

>  <Formula> (2,682)
C10H16N2O3S2

>  <MolWeight> (2,682)
276.37564

>  <PCAT_CMPD_ID> (2,682)
WAY-625279-A

>  <CNC_ID> (2,682)
359334088

>  <transfer_container_id> (2,682)
PTN000000067

>  <COMPOUND_NUMBER> (2,682)
WAY-625279-A

>  <BAR_CODE_NO> (2,682)
90459465

>  <LOCATION_CODE> (2,682)
PTNCS

>  <AMOUNT_CURRENT> (2,682)
32.4

$$$$
WAY-625287
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  3  1  0  0  0  0
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 15  2  1  0  0  0  0
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M  END
>  <Mol_ID> (2,683)
2683

>  <Formula> (2,683)
C16H17NO4S

>  <MolWeight> (2,683)
319.37548

>  <PCAT_CMPD_ID> (2,683)
WAY-625287

>  <CNC_ID> (2,683)
359334096

>  <transfer_container_id> (2,683)
PTN000000067

>  <COMPOUND_NUMBER> (2,683)
WAY-625287

>  <BAR_CODE_NO> (2,683)
90459474

>  <LOCATION_CODE> (2,683)
PTNCS

>  <AMOUNT_CURRENT> (2,683)
32.9

$$$$
WAY-625306
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 15  6  2  0  0  0  0
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M  END
>  <Mol_ID> (2,684)
2684

>  <Formula> (2,684)
C14H20N2O5S2

>  <MolWeight> (2,684)
360.449

>  <PCAT_CMPD_ID> (2,684)
WAY-625306

>  <CNC_ID> (2,684)
359334115

>  <transfer_container_id> (2,684)
PTN000000067

>  <COMPOUND_NUMBER> (2,684)
WAY-625306

>  <BAR_CODE_NO> (2,684)
90459493

>  <LOCATION_CODE> (2,684)
PTNCS

>  <AMOUNT_CURRENT> (2,684)
32.5

$$$$
WAY-625308
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,685)
2685

>  <Formula> (2,685)
C20H18Cl2N4O4

>  <MolWeight> (2,685)
449.28732

>  <PCAT_CMPD_ID> (2,685)
WAY-625308

>  <CNC_ID> (2,685)
359334117

>  <transfer_container_id> (2,685)
PTN000000067

>  <COMPOUND_NUMBER> (2,685)
WAY-625308

>  <BAR_CODE_NO> (2,685)
90459495

>  <LOCATION_CODE> (2,685)
PTNCS

>  <AMOUNT_CURRENT> (2,685)
32.2

$$$$
WAY-625325
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,686)
2686

>  <Formula> (2,686)
C18H14F3N3O3S

>  <MolWeight> (2,686)
409.3822696

>  <PCAT_CMPD_ID> (2,686)
WAY-625325

>  <CNC_ID> (2,686)
359334134

>  <transfer_container_id> (2,686)
PTN000000067

>  <COMPOUND_NUMBER> (2,686)
WAY-625325

>  <BAR_CODE_NO> (2,686)
90459512

>  <LOCATION_CODE> (2,686)
PTNCS

>  <AMOUNT_CURRENT> (2,686)
32.7

$$$$
WAY-625328
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,687)
2687

>  <Formula> (2,687)
C23H25N3O5S

>  <MolWeight> (2,687)
455.5267

>  <PCAT_CMPD_ID> (2,687)
WAY-625328

>  <CNC_ID> (2,687)
359334137

>  <transfer_container_id> (2,687)
PTN000000067

>  <COMPOUND_NUMBER> (2,687)
WAY-625328

>  <BAR_CODE_NO> (2,687)
90459515

>  <LOCATION_CODE> (2,687)
PTNCS

>  <AMOUNT_CURRENT> (2,687)
32.5

$$$$
WAY-625332
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,688)
2688

>  <Formula> (2,688)
C17H12N2O3

>  <MolWeight> (2,688)
292.28878

>  <PCAT_CMPD_ID> (2,688)
WAY-625332

>  <CNC_ID> (2,688)
359334141

>  <transfer_container_id> (2,688)
PTN000000067

>  <COMPOUND_NUMBER> (2,688)
WAY-625332

>  <BAR_CODE_NO> (2,688)
90459519

>  <LOCATION_CODE> (2,688)
PTNCS

>  <AMOUNT_CURRENT> (2,688)
32.2

$$$$
WAY-625365
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,689)
2689

>  <Formula> (2,689)
C26H27N3O3S

>  <MolWeight> (2,689)
461.57588

>  <PCAT_CMPD_ID> (2,689)
WAY-625365

>  <CNC_ID> (2,689)
359334174

>  <transfer_container_id> (2,689)
PTN000000067

>  <COMPOUND_NUMBER> (2,689)
WAY-625365

>  <BAR_CODE_NO> (2,689)
90459553

>  <LOCATION_CODE> (2,689)
PTNCS

>  <AMOUNT_CURRENT> (2,689)
32.4

$$$$
WAY-625382
csChFnd80/10111816222D

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 16  6  1  0  0  0  0
 17  5  1  0  0  0  0
 18  5  2  0  0  0  0
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M  END
>  <Mol_ID> (2,690)
2690

>  <Formula> (2,690)
C17H17N3O4S2

>  <MolWeight> (2,690)
391.46458

>  <PCAT_CMPD_ID> (2,690)
WAY-625382

>  <CNC_ID> (2,690)
359334191

>  <transfer_container_id> (2,690)
PTN000000067

>  <COMPOUND_NUMBER> (2,690)
WAY-625382

>  <BAR_CODE_NO> (2,690)
90459570

>  <LOCATION_CODE> (2,690)
PTNCS

>  <AMOUNT_CURRENT> (2,690)
32.8

$$$$
WAY-625396
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 15  7  1  0  0  0  0
 16  6  1  0  0  0  0
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M  END
>  <Mol_ID> (2,691)
2691

>  <Formula> (2,691)
C16H19N3O2S

>  <MolWeight> (2,691)
317.40596

>  <PCAT_CMPD_ID> (2,691)
WAY-625396

>  <CNC_ID> (2,691)
359334205

>  <transfer_container_id> (2,691)
PTN000000067

>  <COMPOUND_NUMBER> (2,691)
WAY-625396

>  <BAR_CODE_NO> (2,691)
90459585

>  <LOCATION_CODE> (2,691)
PTNCS

>  <AMOUNT_CURRENT> (2,691)
32.3

$$$$
WAY-625453
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,692)
2692

>  <Formula> (2,692)
C24H26N2O6S

>  <MolWeight> (2,692)
470.53804

>  <PCAT_CMPD_ID> (2,692)
WAY-625453

>  <CNC_ID> (2,692)
359334262

>  <transfer_container_id> (2,692)
PTN000000067

>  <COMPOUND_NUMBER> (2,692)
WAY-625453

>  <BAR_CODE_NO> (2,692)
90459643

>  <LOCATION_CODE> (2,692)
PTNCS

>  <AMOUNT_CURRENT> (2,692)
32.4

$$$$
WAY-625474
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,693)
2693

>  <Formula> (2,693)
C26H26ClN3O2

>  <MolWeight> (2,693)
447.95654

>  <PCAT_CMPD_ID> (2,693)
WAY-625474

>  <CNC_ID> (2,693)
359334283

>  <transfer_container_id> (2,693)
PTN000000067

>  <COMPOUND_NUMBER> (2,693)
WAY-625474

>  <BAR_CODE_NO> (2,693)
90459664

>  <LOCATION_CODE> (2,693)
PTNCS

>  <AMOUNT_CURRENT> (2,693)
32.6

$$$$
WAY-625498
csChFnd80/10111816222D

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 18  6  1  0  0  0  0
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M  END
>  <Mol_ID> (2,694)
2694

>  <Formula> (2,694)
C21H20N4O6S

>  <MolWeight> (2,694)
456.4717

>  <PCAT_CMPD_ID> (2,694)
WAY-625498

>  <CNC_ID> (2,694)
359334307

>  <transfer_container_id> (2,694)
PTN000000067

>  <COMPOUND_NUMBER> (2,694)
WAY-625498

>  <BAR_CODE_NO> (2,694)
90459688

>  <LOCATION_CODE> (2,694)
PTNCS

>  <AMOUNT_CURRENT> (2,694)
32.4

$$$$
WAY-625531
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,695)
2695

>  <Formula> (2,695)
C19H17N3O4S

>  <MolWeight> (2,695)
383.42098

>  <PCAT_CMPD_ID> (2,695)
WAY-625531

>  <CNC_ID> (2,695)
359334340

>  <transfer_container_id> (2,695)
PTN000000067

>  <COMPOUND_NUMBER> (2,695)
WAY-625531

>  <BAR_CODE_NO> (2,695)
90459721

>  <LOCATION_CODE> (2,695)
PTNCS

>  <AMOUNT_CURRENT> (2,695)
32.6

$$$$
WAY-625533
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 14  2  1  0  0  0  0
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M  END
>  <Mol_ID> (2,696)
2696

>  <Formula> (2,696)
C18H19NO2

>  <MolWeight> (2,696)
281.34896

>  <PCAT_CMPD_ID> (2,696)
WAY-625533

>  <CNC_ID> (2,696)
359334342

>  <transfer_container_id> (2,696)
PTN000000067

>  <COMPOUND_NUMBER> (2,696)
WAY-625533

>  <BAR_CODE_NO> (2,696)
90459723

>  <LOCATION_CODE> (2,696)
PTNCS

>  <AMOUNT_CURRENT> (2,696)
32.8

$$$$
WAY-625535
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,697)
2697

>  <Formula> (2,697)
C20H20ClN3O2S

>  <MolWeight> (2,697)
401.9097

>  <PCAT_CMPD_ID> (2,697)
WAY-625535

>  <CNC_ID> (2,697)
359334344

>  <transfer_container_id> (2,697)
PTN000000067

>  <COMPOUND_NUMBER> (2,697)
WAY-625535

>  <BAR_CODE_NO> (2,697)
90459725

>  <LOCATION_CODE> (2,697)
PTNCS

>  <AMOUNT_CURRENT> (2,697)
32.9

$$$$
WAY-625610
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,698)
2698

>  <Formula> (2,698)
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>  <MolWeight> (2,698)
306.40316

>  <PCAT_CMPD_ID> (2,698)
WAY-625610

>  <CNC_ID> (2,698)
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>  <transfer_container_id> (2,698)
PTN000000067

>  <COMPOUND_NUMBER> (2,698)
WAY-625610

>  <BAR_CODE_NO> (2,698)
90459803

>  <LOCATION_CODE> (2,698)
PTNCS

>  <AMOUNT_CURRENT> (2,698)
32.3

$$$$
WAY-625658
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,699)
2699

>  <Formula> (2,699)
C18H24N2O5

>  <MolWeight> (2,699)
348.39356

>  <PCAT_CMPD_ID> (2,699)
WAY-625658

>  <CNC_ID> (2,699)
359334467

>  <transfer_container_id> (2,699)
PTN000000067

>  <COMPOUND_NUMBER> (2,699)
WAY-625658

>  <BAR_CODE_NO> (2,699)
90459851

>  <LOCATION_CODE> (2,699)
PTNCS

>  <AMOUNT_CURRENT> (2,699)
32.1

$$$$
WAY-625668
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,700)
2700

>  <Formula> (2,700)
C22H25N3O5S

>  <MolWeight> (2,700)
443.516

>  <PCAT_CMPD_ID> (2,700)
WAY-625668

>  <CNC_ID> (2,700)
359334477

>  <transfer_container_id> (2,700)
PTN000000067

>  <COMPOUND_NUMBER> (2,700)
WAY-625668

>  <BAR_CODE_NO> (2,700)
90459861

>  <LOCATION_CODE> (2,700)
PTNCS

>  <AMOUNT_CURRENT> (2,700)
33

$$$$
WAY-625678
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,701)
2701

>  <Formula> (2,701)
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>  <MolWeight> (2,701)
405.44642

>  <PCAT_CMPD_ID> (2,701)
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>  <CNC_ID> (2,701)
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>  <transfer_container_id> (2,701)
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>  <COMPOUND_NUMBER> (2,701)
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>  <BAR_CODE_NO> (2,701)
90459871

>  <LOCATION_CODE> (2,701)
PTNCS

>  <AMOUNT_CURRENT> (2,701)
32.8

$$$$
WAY-625679
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,702)
2702

>  <Formula> (2,702)
C25H32N2O5

>  <MolWeight> (2,702)
440.53198

>  <PCAT_CMPD_ID> (2,702)
WAY-625679

>  <CNC_ID> (2,702)
359334488

>  <transfer_container_id> (2,702)
PTN000000067

>  <COMPOUND_NUMBER> (2,702)
WAY-625679

>  <BAR_CODE_NO> (2,702)
90459872

>  <LOCATION_CODE> (2,702)
PTNCS

>  <AMOUNT_CURRENT> (2,702)
32

$$$$
WAY-625681
csChFnd80/10111816222D

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 14  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,703)
2703

>  <Formula> (2,703)
C22H24N2O7S

>  <MolWeight> (2,703)
460.50016

>  <PCAT_CMPD_ID> (2,703)
WAY-625681

>  <CNC_ID> (2,703)
359334490

>  <transfer_container_id> (2,703)
PTN000000067

>  <COMPOUND_NUMBER> (2,703)
WAY-625681

>  <BAR_CODE_NO> (2,703)
90459874

>  <LOCATION_CODE> (2,703)
PTNCS

>  <AMOUNT_CURRENT> (2,703)
32.8

$$$$
WAY-625695
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,704)
2704

>  <Formula> (2,704)
C20H15FN4OS

>  <MolWeight> (2,704)
378.4227032

>  <PCAT_CMPD_ID> (2,704)
WAY-625695

>  <CNC_ID> (2,704)
359334504

>  <transfer_container_id> (2,704)
PTN000000067

>  <COMPOUND_NUMBER> (2,704)
WAY-625695

>  <BAR_CODE_NO> (2,704)
90459888

>  <LOCATION_CODE> (2,704)
PTNCS

>  <AMOUNT_CURRENT> (2,704)
32.3

$$$$
WAY-625714
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,705)
2705

>  <Formula> (2,705)
C12H13N3OS

>  <MolWeight> (2,705)
247.31612

>  <PCAT_CMPD_ID> (2,705)
WAY-625714

>  <CNC_ID> (2,705)
359334523

>  <transfer_container_id> (2,705)
PTN000000067

>  <COMPOUND_NUMBER> (2,705)
WAY-625714

>  <BAR_CODE_NO> (2,705)
90459907

>  <LOCATION_CODE> (2,705)
PTNCS

>  <AMOUNT_CURRENT> (2,705)
32.2

$$$$
WAY-625715
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,706)
2706

>  <Formula> (2,706)
C14H24N2

>  <MolWeight> (2,706)
220.35376

>  <PCAT_CMPD_ID> (2,706)
WAY-625715

>  <CNC_ID> (2,706)
359334524

>  <transfer_container_id> (2,706)
PTN000000067

>  <COMPOUND_NUMBER> (2,706)
WAY-625715

>  <BAR_CODE_NO> (2,706)
90459908

>  <LOCATION_CODE> (2,706)
PTNCS

>  <AMOUNT_CURRENT> (2,706)
32.2

$$$$
WAY-625722
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 15  9  1  0  0  0  0
 16  2  1  0  0  0  0
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  5  4  2  0  0  0  0
  7  6  2  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,707)
2707

>  <Formula> (2,707)
C13H15N5OS2

>  <MolWeight> (2,707)
321.4211

>  <PCAT_CMPD_ID> (2,707)
WAY-625722

>  <CNC_ID> (2,707)
359334531

>  <transfer_container_id> (2,707)
PTN000000067

>  <COMPOUND_NUMBER> (2,707)
WAY-625722

>  <BAR_CODE_NO> (2,707)
90459915

>  <LOCATION_CODE> (2,707)
PTNCS

>  <AMOUNT_CURRENT> (2,707)
32.4

$$$$
WAY-625760
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 11 18  1  0  0  0  0
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 13 21  1  0  0  0  0
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 22  3  1  0  0  0  0
 23  5  1  0  0  0  0
 24  6  1  0  0  0  0
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  4  3  1  0  0  0  0
 29 24  2  0  0  0  0
 13  8  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,708)
2708

>  <Formula> (2,708)
C21H18N2O6

>  <MolWeight> (2,708)
394.37742

>  <PCAT_CMPD_ID> (2,708)
WAY-625760

>  <CNC_ID> (2,708)
359334569

>  <transfer_container_id> (2,708)
PTN000000067

>  <COMPOUND_NUMBER> (2,708)
WAY-625760

>  <BAR_CODE_NO> (2,708)
90459953

>  <LOCATION_CODE> (2,708)
PTNCS

>  <AMOUNT_CURRENT> (2,708)
32.9

$$$$
WAY-625763
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
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 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
 15 12  1  0  0  0  0
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 17  8  1  0  0  0  0
 18 10  2  0  0  0  0
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 20  3  1  0  0  0  0
 21  4  1  0  0  0  0
 22  6  1  0  0  0  0
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  4  6  2  0  0  0  0
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 12  7  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,709)
2709

>  <Formula> (2,709)
C20H16O6

>  <MolWeight> (2,709)
352.33744

>  <PCAT_CMPD_ID> (2,709)
WAY-625763

>  <CNC_ID> (2,709)
359334572

>  <transfer_container_id> (2,709)
PTN000000067

>  <COMPOUND_NUMBER> (2,709)
WAY-625763

>  <BAR_CODE_NO> (2,709)
90459956

>  <LOCATION_CODE> (2,709)
PTNCS

>  <AMOUNT_CURRENT> (2,709)
32.6

$$$$
WAY-625780
csChFnd80/10111816222D

 25 29  0  0  0  0  0  0  0  0999 V2000
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 17  6  2  0  0  0  0
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 14  8  1  0  0  0  0
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 16 10  1  0  0  0  0
 21 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,710)
2710

>  <Formula> (2,710)
C16H10N6OS2

>  <MolWeight> (2,710)
366.4202

>  <PCAT_CMPD_ID> (2,710)
WAY-625780

>  <CNC_ID> (2,710)
359334589

>  <transfer_container_id> (2,710)
PTN000000067

>  <COMPOUND_NUMBER> (2,710)
WAY-625780

>  <BAR_CODE_NO> (2,710)
90459973

>  <LOCATION_CODE> (2,710)
PTNCS

>  <AMOUNT_CURRENT> (2,710)
33

$$$$
WAY-625806
csChFnd80/10111816222D

 35 38  0  0  0  0  0  0  0  0999 V2000
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 35 30  2  0  0  0  0
  4  3  1  0  0  0  0
 10  7  2  0  0  0  0
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 34 33  1  0  0  0  0
M  END
>  <Mol_ID> (2,711)
2711

>  <Formula> (2,711)
C24H29N5O5S

>  <MolWeight> (2,711)
499.58256

>  <PCAT_CMPD_ID> (2,711)
WAY-625806

>  <CNC_ID> (2,711)
359334615

>  <transfer_container_id> (2,711)
PTN000000067

>  <COMPOUND_NUMBER> (2,711)
WAY-625806

>  <BAR_CODE_NO> (2,711)
90460000

>  <LOCATION_CODE> (2,711)
PTNCS

>  <AMOUNT_CURRENT> (2,711)
32.5

$$$$
WAY-625817
csChFnd80/10111816222D

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 17  3  2  0  0  0  0
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 20  9  1  0  0  0  0
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 22 16  1  0  0  0  0
 12 11  1  0  0  0  0
  5  4  1  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,712)
2712

>  <Formula> (2,712)
C16H19N3O2S

>  <MolWeight> (2,712)
317.40596

>  <PCAT_CMPD_ID> (2,712)
WAY-625817

>  <CNC_ID> (2,712)
359334626

>  <transfer_container_id> (2,712)
PTN000000067

>  <COMPOUND_NUMBER> (2,712)
WAY-625817

>  <BAR_CODE_NO> (2,712)
90460011

>  <LOCATION_CODE> (2,712)
PTNCS

>  <AMOUNT_CURRENT> (2,712)
32.2

$$$$
WAY-625826
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 11  4  2  0  0  0  0
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 15  5  1  0  0  0  0
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  6  5  2  0  0  0  0
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 28 24  2  0  0  0  0
 18 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,713)
2713

>  <Formula> (2,713)
C21H20N4O2S2

>  <MolWeight> (2,713)
424.5391

>  <PCAT_CMPD_ID> (2,713)
WAY-625826

>  <CNC_ID> (2,713)
359334635

>  <transfer_container_id> (2,713)
PTN000000067

>  <COMPOUND_NUMBER> (2,713)
WAY-625826

>  <BAR_CODE_NO> (2,713)
90460020

>  <LOCATION_CODE> (2,713)
PTNCS

>  <AMOUNT_CURRENT> (2,713)
32.2

$$$$
WAY-625828
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 12  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,714)
2714

>  <Formula> (2,714)
C24H21N5O2S

>  <MolWeight> (2,714)
443.52084

>  <PCAT_CMPD_ID> (2,714)
WAY-625828

>  <CNC_ID> (2,714)
359334637

>  <transfer_container_id> (2,714)
PTN000000067

>  <COMPOUND_NUMBER> (2,714)
WAY-625828

>  <BAR_CODE_NO> (2,714)
90460022

>  <LOCATION_CODE> (2,714)
PTNCS

>  <AMOUNT_CURRENT> (2,714)
32.9

$$$$
WAY-625841
csChFnd80/10111816222D

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 14 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,715)
2715

>  <Formula> (2,715)
C17H15N3O2S

>  <MolWeight> (2,715)
325.3849

>  <PCAT_CMPD_ID> (2,715)
WAY-625841

>  <CNC_ID> (2,715)
359334650

>  <transfer_container_id> (2,715)
PTN000000067

>  <COMPOUND_NUMBER> (2,715)
WAY-625841

>  <BAR_CODE_NO> (2,715)
90460035

>  <LOCATION_CODE> (2,715)
PTNCS

>  <AMOUNT_CURRENT> (2,715)
32.2

$$$$
WAY-625849
csChFnd80/10111816222D

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 10  7  1  0  0  0  0
 11  2  2  0  0  0  0
 12 13  1  0  0  0  0
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 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16 11  1  0  0  0  0
 17 25  2  0  0  0  0
 18 20  2  0  0  0  0
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 22 30  1  0  0  0  0
 23  8  1  0  0  0  0
 24  8  1  0  0  0  0
 25 20  1  0  0  0  0
 26  3  1  0  0  0  0
 27  6  1  0  0  0  0
 28  9  1  0  0  0  0
 29 23  1  0  0  0  0
 30 24  1  0  0  0  0
 31 26  1  0  0  0  0
 32 33  1  0  0  0  0
 33 28  2  0  0  0  0
 22 29  1  0  0  0  0
 16 10  2  0  0  0  0
  5  4  2  0  0  0  0
  6  3  1  0  0  0  0
 32 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,716)
2716

>  <Formula> (2,716)
C24H25N3O4S2

>  <MolWeight> (2,716)
483.603

>  <PCAT_CMPD_ID> (2,716)
WAY-625849

>  <CNC_ID> (2,716)
359334658

>  <transfer_container_id> (2,716)
PTN000000067

>  <COMPOUND_NUMBER> (2,716)
WAY-625849

>  <BAR_CODE_NO> (2,716)
90460043

>  <LOCATION_CODE> (2,716)
PTNCS

>  <AMOUNT_CURRENT> (2,716)
32.6

$$$$
WAY-625853
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  6  1  0  0  0  0
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  7  8  2  0  0  0  0
  8 11  1  0  0  0  0
  9  7  1  0  0  0  0
 10  1  1  0  0  0  0
 11 12  1  0  0  0  0
 12 18  1  0  0  0  0
 13  2  1  0  0  0  0
 14  6  2  0  0  0  0
 15  9  2  0  0  0  0
 16  4  1  0  0  0  0
 17 12  2  0  0  0  0
 18 10  1  0  0  0  0
 19  9  1  0  0  0  0
 20  7  1  0  0  0  0
 21  8  1  0  0  0  0
 22 13  1  0  0  0  0
 23 13  1  0  0  0  0
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 25 26  1  0  0  0  0
 26 21  2  0  0  0  0
 27 23  1  0  0  0  0
 28 22  1  0  0  0  0
  5  4  2  0  0  0  0
 27 28  1  0  0  0  0
 25 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,717)
2717

>  <Formula> (2,717)
C19H21N3O5S

>  <MolWeight> (2,717)
403.45214

>  <PCAT_CMPD_ID> (2,717)
WAY-625853

>  <CNC_ID> (2,717)
359334662

>  <transfer_container_id> (2,717)
PTN000000067

>  <COMPOUND_NUMBER> (2,717)
WAY-625853

>  <BAR_CODE_NO> (2,717)
90460047

>  <LOCATION_CODE> (2,717)
PTNCS

>  <AMOUNT_CURRENT> (2,717)
32.5

$$$$
WAY-625858
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6 15  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  2  1  0  0  0  0
 10  1  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14 12  1  0  0  0  0
 15 17  1  0  0  0  0
 16 14  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  2  0  0  0  0
 19 18  1  0  0  0  0
 20  9  2  0  0  0  0
 21  3  1  0  0  0  0
 22  5  1  0  0  0  0
 23 11  1  0  0  0  0
  4  2  1  0  0  0  0
 16 19  2  0  0  0  0
 13 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,718)
2718

>  <Formula> (2,718)
C17H18N2OS3

>  <MolWeight> (2,718)
362.53262

>  <PCAT_CMPD_ID> (2,718)
WAY-625858

>  <CNC_ID> (2,718)
359334667

>  <transfer_container_id> (2,718)
PTN000000067

>  <COMPOUND_NUMBER> (2,718)
WAY-625858

>  <BAR_CODE_NO> (2,718)
90460052

>  <LOCATION_CODE> (2,718)
PTNCS

>  <AMOUNT_CURRENT> (2,718)
32.2

$$$$
WAY-625875
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
  3  2  2  0  0  0  0
  4  7  1  0  0  0  0
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  6  1  1  0  0  0  0
  7 11  1  0  0  0  0
  8  1  1  0  0  0  0
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 10  5  1  0  0  0  0
 11 12  2  0  0  0  0
 12  8  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  7  2  0  0  0  0
 16  6  1  0  0  0  0
 17  6  1  0  0  0  0
 18  8  2  0  0  0  0
 19 20  2  0  0  0  0
 20 18  1  0  0  0  0
 21  9  1  0  0  0  0
 22 10  1  0  0  0  0
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 25 22  2  0  0  0  0
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 19 11  1  0  0  0  0
 27 24  1  0  0  0  0
 10  9  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,719)
2719

>  <Formula> (2,719)
C19H20N4O3S

>  <MolWeight> (2,719)
384.4521

>  <PCAT_CMPD_ID> (2,719)
WAY-625875

>  <CNC_ID> (2,719)
359334684

>  <transfer_container_id> (2,719)
PTN000000067

>  <COMPOUND_NUMBER> (2,719)
WAY-625875

>  <BAR_CODE_NO> (2,719)
90460069

>  <LOCATION_CODE> (2,719)
PTNCS

>  <AMOUNT_CURRENT> (2,719)
32.3

$$$$
WAY-625884
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 11  1  2  0  0  0  0
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 14  5  2  0  0  0  0
 15  2  1  0  0  0  0
 16  9  1  0  0  0  0
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 22  3  1  0  0  0  0
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 13  7  2  0  0  0  0
 18 12  2  0  0  0  0
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M  END
>  <Mol_ID> (2,720)
2720

>  <Formula> (2,720)
C22H23N3O4S

>  <MolWeight> (2,720)
425.50072

>  <PCAT_CMPD_ID> (2,720)
WAY-625884

>  <CNC_ID> (2,720)
359334693

>  <transfer_container_id> (2,720)
PTN000000067

>  <COMPOUND_NUMBER> (2,720)
WAY-625884

>  <BAR_CODE_NO> (2,720)
90460078

>  <LOCATION_CODE> (2,720)
PTNCS

>  <AMOUNT_CURRENT> (2,720)
32.9

$$$$
WAY-625887
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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  5  6  1  0  0  0  0
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 10 14  2  0  0  0  0
 11 13  1  0  0  0  0
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 15  2  1  0  0  0  0
 16 23  1  0  0  0  0
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 18  3  1  0  0  0  0
 19  4  1  0  0  0  0
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 21  5  1  0  0  0  0
 22  7  1  0  0  0  0
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 20  7  1  0  0  0  0
 26 22  2  0  0  0  0
  6 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,721)
2721

>  <Formula> (2,721)
C22H25NO3

>  <MolWeight> (2,721)
351.4388

>  <PCAT_CMPD_ID> (2,721)
WAY-625887

>  <CNC_ID> (2,721)
359334696

>  <transfer_container_id> (2,721)
PTN000000067

>  <COMPOUND_NUMBER> (2,721)
WAY-625887

>  <BAR_CODE_NO> (2,721)
90460081

>  <LOCATION_CODE> (2,721)
PTNCS

>  <AMOUNT_CURRENT> (2,721)
33

$$$$
WAY-625895
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  5  2  0  0  0  0
 12  3  1  0  0  0  0
 13 11  1  0  0  0  0
 14  4  2  0  0  0  0
 15  7  2  0  0  0  0
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 20  5  1  0  0  0  0
 21  7  1  0  0  0  0
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 30 25  2  0  0  0  0
 17 12  2  0  0  0  0
 29 31  1  0  0  0  0
M  END
>  <Mol_ID> (2,722)
2722

>  <Formula> (2,722)
C23H19N3O4S

>  <MolWeight> (2,722)
433.47966

>  <PCAT_CMPD_ID> (2,722)
WAY-625895

>  <CNC_ID> (2,722)
359334704

>  <transfer_container_id> (2,722)
PTN000000067

>  <COMPOUND_NUMBER> (2,722)
WAY-625895

>  <BAR_CODE_NO> (2,722)
90460089

>  <LOCATION_CODE> (2,722)
PTNCS

>  <AMOUNT_CURRENT> (2,722)
32.8

$$$$
WAY-625905
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11 10  1  0  0  0  0
 12  6  2  0  0  0  0
 13  8  2  0  0  0  0
 14 10  2  0  0  0  0
 15  5  1  0  0  0  0
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 17  4  1  0  0  0  0
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  7  8  1  0  0  0  0
  3  5  2  0  0  0  0
 24 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,723)
2723

>  <Formula> (2,723)
C16H15N3O4S

>  <MolWeight> (2,723)
345.373

>  <PCAT_CMPD_ID> (2,723)
WAY-625905

>  <CNC_ID> (2,723)
359334714

>  <transfer_container_id> (2,723)
PTN000000067

>  <COMPOUND_NUMBER> (2,723)
WAY-625905

>  <BAR_CODE_NO> (2,723)
90460099

>  <LOCATION_CODE> (2,723)
PTNCS

>  <AMOUNT_CURRENT> (2,723)
32.9

$$$$
WAY-625913
csChFnd80/10111816222D

 11 12  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
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M  END
>  <Mol_ID> (2,724)
2724

>  <Formula> (2,724)
C6H9N5

>  <MolWeight> (2,724)
151.16916

>  <PCAT_CMPD_ID> (2,724)
WAY-625913

>  <CNC_ID> (2,724)
359334722

>  <transfer_container_id> (2,724)
PTN000000067

>  <COMPOUND_NUMBER> (2,724)
WAY-625913

>  <BAR_CODE_NO> (2,724)
90460107

>  <LOCATION_CODE> (2,724)
PTNCS

>  <AMOUNT_CURRENT> (2,724)
32.4

$$$$
WAY-625932
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,725)
2725

>  <Formula> (2,725)
C22H20N4O4S

>  <MolWeight> (2,725)
436.4836

>  <PCAT_CMPD_ID> (2,725)
WAY-625932

>  <CNC_ID> (2,725)
359334741

>  <transfer_container_id> (2,725)
PTN000000067

>  <COMPOUND_NUMBER> (2,725)
WAY-625932

>  <BAR_CODE_NO> (2,725)
90460126

>  <LOCATION_CODE> (2,725)
PTNCS

>  <AMOUNT_CURRENT> (2,725)
32.4

$$$$
WAY-625938
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,726)
2726

>  <Formula> (2,726)
C22H19ClN2O5S

>  <MolWeight> (2,726)
458.91466

>  <PCAT_CMPD_ID> (2,726)
WAY-625938

>  <CNC_ID> (2,726)
359334747

>  <transfer_container_id> (2,726)
PTN000000067

>  <COMPOUND_NUMBER> (2,726)
WAY-625938

>  <BAR_CODE_NO> (2,726)
90460132

>  <LOCATION_CODE> (2,726)
PTNCS

>  <AMOUNT_CURRENT> (2,726)
32.4

$$$$
WAY-625949
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,727)
2727

>  <Formula> (2,727)
C14H13ClN2OS

>  <MolWeight> (2,727)
292.78382

>  <PCAT_CMPD_ID> (2,727)
WAY-625949

>  <CNC_ID> (2,727)
359334758

>  <transfer_container_id> (2,727)
PTN000000067

>  <COMPOUND_NUMBER> (2,727)
WAY-625949

>  <BAR_CODE_NO> (2,727)
90460143

>  <LOCATION_CODE> (2,727)
PTNCS

>  <AMOUNT_CURRENT> (2,727)
33

$$$$
WAY-625951
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,728)
2728

>  <Formula> (2,728)
C15H14N2O2S3

>  <MolWeight> (2,728)
350.47886

>  <PCAT_CMPD_ID> (2,728)
WAY-625951

>  <CNC_ID> (2,728)
359334760

>  <transfer_container_id> (2,728)
PTN000000067

>  <COMPOUND_NUMBER> (2,728)
WAY-625951

>  <BAR_CODE_NO> (2,728)
90460145

>  <LOCATION_CODE> (2,728)
PTNCS

>  <AMOUNT_CURRENT> (2,728)
32.6

$$$$
WAY-625965
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,729)
2729

>  <Formula> (2,729)
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>  <MolWeight> (2,729)
367.44304

>  <PCAT_CMPD_ID> (2,729)
WAY-625965

>  <CNC_ID> (2,729)
359334774

>  <transfer_container_id> (2,729)
PTN000000067

>  <COMPOUND_NUMBER> (2,729)
WAY-625965

>  <BAR_CODE_NO> (2,729)
90460159

>  <LOCATION_CODE> (2,729)
PTNCS

>  <AMOUNT_CURRENT> (2,729)
32.5

$$$$
WAY-626001
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 11  1  2  0  0  0  0
 12  2  1  0  0  0  0
 13 15  1  0  0  0  0
 14  2  2  0  0  0  0
 15  1  1  0  0  0  0
 16 17  1  0  0  0  0
 17  7  1  0  0  0  0
 18  7  2  0  0  0  0
 19  6  1  0  0  0  0
 20 23  1  0  0  0  0
 21  9  1  0  0  0  0
 22 19  1  0  0  0  0
 23 21  2  0  0  0  0
 13  5  1  0  0  0  0
 20  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,730)
2730

>  <Formula> (2,730)
C13H17N3O6S

>  <MolWeight> (2,730)
343.35558

>  <PCAT_CMPD_ID> (2,730)
WAY-626001

>  <CNC_ID> (2,730)
359334810

>  <transfer_container_id> (2,730)
PTN000000067

>  <COMPOUND_NUMBER> (2,730)
WAY-626001

>  <BAR_CODE_NO> (2,730)
90460195

>  <LOCATION_CODE> (2,730)
PTNCS

>  <AMOUNT_CURRENT> (2,730)
32.5

$$$$
WAY-626068
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  5  1  0  0  0  0
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  7  3  1  0  0  0  0
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 10 15  1  0  0  0  0
 11  4  2  0  0  0  0
 12 10  1  0  0  0  0
 13 16  2  0  0  0  0
 14  2  1  0  0  0  0
 15  4  1  0  0  0  0
 16 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18  7  1  0  0  0  0
 19  8  1  0  0  0  0
 20 17  1  0  0  0  0
 21 17  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
 24 23  1  0  0  0  0
  6  3  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,731)
2731

>  <Formula> (2,731)
C18H17NO4S

>  <MolWeight> (2,731)
343.39688

>  <PCAT_CMPD_ID> (2,731)
WAY-626068

>  <CNC_ID> (2,731)
359334877

>  <transfer_container_id> (2,731)
PTN000000067

>  <COMPOUND_NUMBER> (2,731)
WAY-626068

>  <BAR_CODE_NO> (2,731)
90460262

>  <LOCATION_CODE> (2,731)
PTNCS

>  <AMOUNT_CURRENT> (2,731)
32.3

$$$$
WAY-626080
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  1  2  0  0  0  0
 12  2  2  0  0  0  0
 13  4  1  0  0  0  0
 14  4  1  0  0  0  0
 15  6  1  0  0  0  0
 16  5  1  0  0  0  0
 17 19  1  0  0  0  0
 18  7  1  0  0  0  0
 19 15  2  0  0  0  0
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 17  8  2  0  0  0  0
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 24 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,732)
2732

>  <Formula> (2,732)
C18H19N3O3

>  <MolWeight> (2,732)
325.36176

>  <PCAT_CMPD_ID> (2,732)
WAY-626080

>  <CNC_ID> (2,732)
359334889

>  <transfer_container_id> (2,732)
PTN000000067

>  <COMPOUND_NUMBER> (2,732)
WAY-626080

>  <BAR_CODE_NO> (2,732)
90460274

>  <LOCATION_CODE> (2,732)
PTNCS

>  <AMOUNT_CURRENT> (2,732)
32.1

$$$$
WAY-626101
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 15  9  1  0  0  0  0
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 10  9  1  0  0  0  0
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 16 14  2  0  0  0  0
 17 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,733)
2733

>  <Formula> (2,733)
C19H20N2O4S2

>  <MolWeight> (2,733)
404.5031

>  <PCAT_CMPD_ID> (2,733)
WAY-626101

>  <CNC_ID> (2,733)
359334910

>  <transfer_container_id> (2,733)
PTN000000067

>  <COMPOUND_NUMBER> (2,733)
WAY-626101

>  <BAR_CODE_NO> (2,733)
90460295

>  <LOCATION_CODE> (2,733)
PTNCS

>  <AMOUNT_CURRENT> (2,733)
32.3

$$$$
WAY-626122
csChFnd80/10111816222D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,734)
2734

>  <Formula> (2,734)
C7H10N4O

>  <MolWeight> (2,734)
166.1805

>  <PCAT_CMPD_ID> (2,734)
WAY-626122

>  <CNC_ID> (2,734)
359334931

>  <transfer_container_id> (2,734)
PTN000000067

>  <COMPOUND_NUMBER> (2,734)
WAY-626122

>  <BAR_CODE_NO> (2,734)
90460316

>  <LOCATION_CODE> (2,734)
PTNCS

>  <AMOUNT_CURRENT> (2,734)
32.1

$$$$
WAY-626163
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,735)
2735

>  <Formula> (2,735)
C16H19NO5

>  <MolWeight> (2,735)
305.32576

>  <PCAT_CMPD_ID> (2,735)
WAY-626163

>  <CNC_ID> (2,735)
359334972

>  <transfer_container_id> (2,735)
PTN000000067

>  <COMPOUND_NUMBER> (2,735)
WAY-626163

>  <BAR_CODE_NO> (2,735)
90460357

>  <LOCATION_CODE> (2,735)
PTNCS

>  <AMOUNT_CURRENT> (2,735)
32.7

$$$$
WAY-626165
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,736)
2736

>  <Formula> (2,736)
C18H17FN4O4S

>  <MolWeight> (2,736)
404.4153832

>  <PCAT_CMPD_ID> (2,736)
WAY-626165

>  <CNC_ID> (2,736)
359334974

>  <transfer_container_id> (2,736)
PTN000000067

>  <COMPOUND_NUMBER> (2,736)
WAY-626165

>  <BAR_CODE_NO> (2,736)
90460359

>  <LOCATION_CODE> (2,736)
PTNCS

>  <AMOUNT_CURRENT> (2,736)
32.4

$$$$
WAY-626196
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,737)
2737

>  <Formula> (2,737)
C19H17NO4

>  <MolWeight> (2,737)
323.34258

>  <PCAT_CMPD_ID> (2,737)
WAY-626196

>  <CNC_ID> (2,737)
359335005

>  <transfer_container_id> (2,737)
PTN000000067

>  <COMPOUND_NUMBER> (2,737)
WAY-626196

>  <BAR_CODE_NO> (2,737)
90460391

>  <LOCATION_CODE> (2,737)
PTNCS

>  <AMOUNT_CURRENT> (2,737)
32.4

$$$$
WAY-626203
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,738)
2738

>  <Formula> (2,738)
C14H17N3O3S

>  <MolWeight> (2,738)
307.36808

>  <PCAT_CMPD_ID> (2,738)
WAY-626203

>  <CNC_ID> (2,738)
359335012

>  <transfer_container_id> (2,738)
PTN000000067

>  <COMPOUND_NUMBER> (2,738)
WAY-626203

>  <BAR_CODE_NO> (2,738)
90460398

>  <LOCATION_CODE> (2,738)
PTNCS

>  <AMOUNT_CURRENT> (2,738)
32.9

$$$$
WAY-626207
csChFnd80/10111816222D

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>  <Mol_ID> (2,739)
2739

>  <Formula> (2,739)
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>  <MolWeight> (2,739)
407.51034

>  <PCAT_CMPD_ID> (2,739)
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>  <CNC_ID> (2,739)
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>  <transfer_container_id> (2,739)
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>  <COMPOUND_NUMBER> (2,739)
WAY-626207

>  <BAR_CODE_NO> (2,739)
90460402

>  <LOCATION_CODE> (2,739)
PTNCS

>  <AMOUNT_CURRENT> (2,739)
32.7

$$$$
WAY-626222
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
 11  3  1  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  2  0  0  0  0
 16  4  1  0  0  0  0
 17  9  1  0  0  0  0
 18 10  1  0  0  0  0
 19 12  1  0  0  0  0
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 22 17  2  0  0  0  0
 23 22  1  0  0  0  0
 24 20  2  0  0  0  0
 25 19  2  0  0  0  0
  5  4  1  0  0  0  0
 23 18  2  0  0  0  0
 13 12  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,740)
2740

>  <Formula> (2,740)
C18H15N5O2

>  <MolWeight> (2,740)
333.344

>  <PCAT_CMPD_ID> (2,740)
WAY-626222

>  <CNC_ID> (2,740)
359335031

>  <transfer_container_id> (2,740)
PTN000000067

>  <COMPOUND_NUMBER> (2,740)
WAY-626222

>  <BAR_CODE_NO> (2,740)
90460417

>  <LOCATION_CODE> (2,740)
PTNCS

>  <AMOUNT_CURRENT> (2,740)
32.5

$$$$
WAY-626239
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
    0.0792   -1.9792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  1  0  0  0  0
 11  4  2  0  0  0  0
 12 13  2  0  0  0  0
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 15  7  1  0  0  0  0
 16  8  2  0  0  0  0
 17  9  1  0  0  0  0
 18 10  2  0  0  0  0
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  6  9  2  0  0  0  0
 27 24  2  0  0  0  0
 12  7  1  0  0  0  0
 15 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,741)
2741

>  <Formula> (2,741)
C19H12BrCl2N3O2

>  <MolWeight> (2,741)
465.12748

>  <PCAT_CMPD_ID> (2,741)
WAY-626239

>  <CNC_ID> (2,741)
359335048

>  <transfer_container_id> (2,741)
PTN000000067

>  <COMPOUND_NUMBER> (2,741)
WAY-626239

>  <BAR_CODE_NO> (2,741)
90460434

>  <LOCATION_CODE> (2,741)
PTNCS

>  <AMOUNT_CURRENT> (2,741)
32.7

$$$$
WAY-626251
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 18  2  0  0  0  0
 12  1  1  0  0  0  0
 13  1  2  0  0  0  0
 14  3  1  0  0  0  0
 15  3  1  0  0  0  0
 16 15  1  0  0  0  0
 17 14  1  0  0  0  0
 18  6  1  0  0  0  0
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 30 26  1  0  0  0  0
 29 28  2  0  0  0  0
M  END
>  <Mol_ID> (2,742)
2742

>  <Formula> (2,742)
C24H22N4O2

>  <MolWeight> (2,742)
398.45708

>  <PCAT_CMPD_ID> (2,742)
WAY-626251

>  <CNC_ID> (2,742)
359335060

>  <transfer_container_id> (2,742)
PTN000000067

>  <COMPOUND_NUMBER> (2,742)
WAY-626251

>  <BAR_CODE_NO> (2,742)
90460446

>  <LOCATION_CODE> (2,742)
PTNCS

>  <AMOUNT_CURRENT> (2,742)
32.2

$$$$
WAY-626256
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  9  2  0  0  0  0
 12  5  2  0  0  0  0
 13  4  2  0  0  0  0
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 17  2  1  0  0  0  0
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 16 21  1  0  0  0  0
 23 11  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,743)
2743

>  <Formula> (2,743)
C15H16N2O5S

>  <MolWeight> (2,743)
336.36294

>  <PCAT_CMPD_ID> (2,743)
WAY-626256

>  <CNC_ID> (2,743)
359335065

>  <transfer_container_id> (2,743)
PTN000000067

>  <COMPOUND_NUMBER> (2,743)
WAY-626256

>  <BAR_CODE_NO> (2,743)
90460451

>  <LOCATION_CODE> (2,743)
PTNCS

>  <AMOUNT_CURRENT> (2,743)
33

$$$$
WAY-626309
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
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 13  9  1  0  0  0  0
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 16  4  1  0  0  0  0
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  9 14  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,744)
2744

>  <Formula> (2,744)
C19H16N2O2S

>  <MolWeight> (2,744)
336.40754

>  <PCAT_CMPD_ID> (2,744)
WAY-626309

>  <CNC_ID> (2,744)
359335117

>  <transfer_container_id> (2,744)
PTN000000067

>  <COMPOUND_NUMBER> (2,744)
WAY-626309

>  <BAR_CODE_NO> (2,744)
90460505

>  <LOCATION_CODE> (2,744)
PTNCS

>  <AMOUNT_CURRENT> (2,744)
32.1

$$$$
WAY-626332
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 10 18  1  0  0  0  0
 11  8  1  0  0  0  0
 12  2  2  0  0  0  0
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 15  3  1  0  0  0  0
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 23  6  1  0  0  0  0
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 25 10  1  0  0  0  0
 26  9  1  0  0  0  0
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 29 23  2  0  0  0  0
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  9  5  1  0  0  0  0
 30 26  2  0  0  0  0
 20 22  1  0  0  0  0
 19 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,745)
2745

>  <Formula> (2,745)
C24H29N3O3

>  <MolWeight> (2,745)
407.50536

>  <PCAT_CMPD_ID> (2,745)
WAY-626332

>  <CNC_ID> (2,745)
359335140

>  <transfer_container_id> (2,745)
PTN000000067

>  <COMPOUND_NUMBER> (2,745)
WAY-626332

>  <BAR_CODE_NO> (2,745)
90460528

>  <LOCATION_CODE> (2,745)
PTNCS

>  <AMOUNT_CURRENT> (2,745)
32.8

$$$$
WAY-626365
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
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 21  9  1  0  0  0  0
 22 15  1  0  0  0  0
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 26 24  2  0  0  0  0
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M  END
>  <Mol_ID> (2,746)
2746

>  <Formula> (2,746)
C18H15ClN4OS2

>  <MolWeight> (2,746)
402.9209

>  <PCAT_CMPD_ID> (2,746)
WAY-626365

>  <CNC_ID> (2,746)
359335173

>  <transfer_container_id> (2,746)
PTN000000067

>  <COMPOUND_NUMBER> (2,746)
WAY-626365

>  <BAR_CODE_NO> (2,746)
90460562

>  <LOCATION_CODE> (2,746)
PTNCS

>  <AMOUNT_CURRENT> (2,746)
32.2

$$$$
WAY-626415
csChFnd80/10111816222D

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 10  2  1  0  0  0  0
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  3  4  1  0  0  0  0
 23 15  1  0  0  0  0
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M  END
>  <Mol_ID> (2,747)
2747

>  <Formula> (2,747)
C18H17FN4OS

>  <MolWeight> (2,747)
356.4171832

>  <PCAT_CMPD_ID> (2,747)
WAY-626415

>  <CNC_ID> (2,747)
359335222

>  <transfer_container_id> (2,747)
PTN000000067

>  <COMPOUND_NUMBER> (2,747)
WAY-626415

>  <BAR_CODE_NO> (2,747)
90460614

>  <LOCATION_CODE> (2,747)
PTNCS

>  <AMOUNT_CURRENT> (2,747)
32.6

$$$$
WAY-626446
csChFnd80/10111816222D

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 30 29  1  0  0  0  0
M  END
>  <Mol_ID> (2,748)
2748

>  <Formula> (2,748)
C22H25N3O3S2

>  <MolWeight> (2,748)
443.5822

>  <PCAT_CMPD_ID> (2,748)
WAY-626446

>  <CNC_ID> (2,748)
359335253

>  <transfer_container_id> (2,748)
PTN000000067

>  <COMPOUND_NUMBER> (2,748)
WAY-626446

>  <BAR_CODE_NO> (2,748)
90460649

>  <LOCATION_CODE> (2,748)
PTNCS

>  <AMOUNT_CURRENT> (2,748)
32.6

$$$$
WAY-626453
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  7  6  1  0  0  0  0
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  9  5  2  0  0  0  0
 10  8  1  0  0  0  0
 11  3  2  0  0  0  0
 12  6  1  0  0  0  0
 13  1  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  1  0  0  0  0
 16  5  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
 19 12  2  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
 22 19  1  0  0  0  0
 23 18  2  0  0  0  0
 24 22  2  0  0  0  0
  9  4  1  0  0  0  0
  7 10  2  0  0  0  0
 21 17  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,749)
2749

>  <Formula> (2,749)
C18H15N3O2S

>  <MolWeight> (2,749)
337.3956

>  <PCAT_CMPD_ID> (2,749)
WAY-626453

>  <CNC_ID> (2,749)
359335260

>  <transfer_container_id> (2,749)
PTN000000067

>  <COMPOUND_NUMBER> (2,749)
WAY-626453

>  <BAR_CODE_NO> (2,749)
90460657

>  <LOCATION_CODE> (2,749)
PTNCS

>  <AMOUNT_CURRENT> (2,749)
32.8

$$$$
WAY-626466
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  2  1  0  0  0  0
 11 19  1  0  0  0  0
 12  2  2  0  0  0  0
 13 11  1  0  0  0  0
 14  7  1  0  0  0  0
 15  6  2  0  0  0  0
 16 11  2  0  0  0  0
 17 13  1  0  0  0  0
 18 16  1  0  0  0  0
 19  9  1  0  0  0  0
 20  5  1  0  0  0  0
 21  5  1  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
 14  8  2  0  0  0  0
 24 23  1  0  0  0  0
 17 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,750)
2750

>  <Formula> (2,750)
C17H19N3O4

>  <MolWeight> (2,750)
329.35046

>  <PCAT_CMPD_ID> (2,750)
WAY-626466

>  <CNC_ID> (2,750)
359335273

>  <transfer_container_id> (2,750)
PTN000000067

>  <COMPOUND_NUMBER> (2,750)
WAY-626466

>  <BAR_CODE_NO> (2,750)
90460671

>  <LOCATION_CODE> (2,750)
PTNCS

>  <AMOUNT_CURRENT> (2,750)
33

$$$$
WAY-626481
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10 17  1  0  0  0  0
 11  8  1  0  0  0  0
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 13 10  1  0  0  0  0
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 15  9  2  0  0  0  0
 16  9  1  0  0  0  0
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  5  3  1  0  0  0  0
 11  7  2  0  0  0  0
 18 20  2  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,751)
2751

>  <Formula> (2,751)
C19H18FN3O2S

>  <MolWeight> (2,751)
371.4285232

>  <PCAT_CMPD_ID> (2,751)
WAY-626481

>  <CNC_ID> (2,751)
359335288

>  <transfer_container_id> (2,751)
PTN000000067

>  <COMPOUND_NUMBER> (2,751)
WAY-626481

>  <BAR_CODE_NO> (2,751)
90460686

>  <LOCATION_CODE> (2,751)
PTNCS

>  <AMOUNT_CURRENT> (2,751)
33

$$$$
WAY-626490
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
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 22  8  2  0  0  0  0
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 30 21  1  0  0  0  0
 25 28  2  0  0  0  0
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 21  5  2  0  0  0  0
M  END
>  <Mol_ID> (2,752)
2752

>  <Formula> (2,752)
C18H19ClN4O6S

>  <MolWeight> (2,752)
454.88466

>  <PCAT_CMPD_ID> (2,752)
WAY-626490

>  <CNC_ID> (2,752)
359335297

>  <transfer_container_id> (2,752)
PTN000000067

>  <COMPOUND_NUMBER> (2,752)
WAY-626490

>  <BAR_CODE_NO> (2,752)
90460695

>  <LOCATION_CODE> (2,752)
PTNCS

>  <AMOUNT_CURRENT> (2,752)
32.5

$$$$
WAY-626492
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10 14  1  0  0  0  0
 11  5  1  0  0  0  0
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 13  3  1  0  0  0  0
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 15  8  1  0  0  0  0
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 17  2  1  0  0  0  0
 18  4  1  0  0  0  0
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  3  4  1  0  0  0  0
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 19  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,753)
2753

>  <Formula> (2,753)
C19H17N3O4

>  <MolWeight> (2,753)
351.35598

>  <PCAT_CMPD_ID> (2,753)
WAY-626492

>  <CNC_ID> (2,753)
359335299

>  <transfer_container_id> (2,753)
PTN000000067

>  <COMPOUND_NUMBER> (2,753)
WAY-626492

>  <BAR_CODE_NO> (2,753)
90460697

>  <LOCATION_CODE> (2,753)
PTNCS

>  <AMOUNT_CURRENT> (2,753)
32.9

$$$$
WAY-626512
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 11  2  1  0  0  0  0
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 13  5  1  0  0  0  0
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 22  6  1  0  0  0  0
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  4  8  1  0  0  0  0
 18 19  2  0  0  0  0
 29 28  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,754)
2754

>  <Formula> (2,754)
C22H22N4OS2

>  <MolWeight> (2,754)
422.56628

>  <PCAT_CMPD_ID> (2,754)
WAY-626512

>  <CNC_ID> (2,754)
359335319

>  <transfer_container_id> (2,754)
PTN000000067

>  <COMPOUND_NUMBER> (2,754)
WAY-626512

>  <BAR_CODE_NO> (2,754)
90460717

>  <LOCATION_CODE> (2,754)
PTNCS

>  <AMOUNT_CURRENT> (2,754)
32.6

$$$$
WAY-626521
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10 16  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  2  0  0  0  0
 13  2  1  0  0  0  0
 14  2  1  0  0  0  0
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  5 17  1  0  0  0  0
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M  END
>  <Mol_ID> (2,755)
2755

>  <Formula> (2,755)
C19H23ClN4O4S2

>  <MolWeight> (2,755)
470.99332

>  <PCAT_CMPD_ID> (2,755)
WAY-626521

>  <CNC_ID> (2,755)
359335328

>  <transfer_container_id> (2,755)
PTN000000067

>  <COMPOUND_NUMBER> (2,755)
WAY-626521

>  <BAR_CODE_NO> (2,755)
90460726

>  <LOCATION_CODE> (2,755)
PTNCS

>  <AMOUNT_CURRENT> (2,755)
32.8

$$$$
WAY-626534
csChFnd80/10111816222D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 12  5  2  0  0  0  0
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M  END
>  <Mol_ID> (2,756)
2756

>  <Formula> (2,756)
C21H18N4O4S

>  <MolWeight> (2,756)
422.45702

>  <PCAT_CMPD_ID> (2,756)
WAY-626534

>  <CNC_ID> (2,756)
359335341

>  <transfer_container_id> (2,756)
PTN000000067

>  <COMPOUND_NUMBER> (2,756)
WAY-626534

>  <BAR_CODE_NO> (2,756)
90460739

>  <LOCATION_CODE> (2,756)
PTNCS

>  <AMOUNT_CURRENT> (2,756)
32.8

$$$$
WAY-626605
csChFnd80/10111816222D

 26 27  0  0  0  0  0  0  0  0999 V2000
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  2  4  1  0  0  0  0
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 11  3  1  0  0  0  0
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 17  1  1  0  0  0  0
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  6  5  1  0  0  0  0
 21 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,757)
2757

>  <Formula> (2,757)
C16H16ClN3O5S

>  <MolWeight> (2,757)
397.83334

>  <PCAT_CMPD_ID> (2,757)
WAY-626605

>  <CNC_ID> (2,757)
359335412

>  <transfer_container_id> (2,757)
PTN000000067

>  <COMPOUND_NUMBER> (2,757)
WAY-626605

>  <BAR_CODE_NO> (2,757)
90460812

>  <LOCATION_CODE> (2,757)
PTNCS

>  <AMOUNT_CURRENT> (2,757)
33

$$$$
WAY-626743
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 13  4  1  0  0  0  0
 14  8  2  0  0  0  0
 15  5  2  0  0  0  0
 16  7  2  0  0  0  0
 17  6  1  0  0  0  0
 18 19  1  0  0  0  0
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 18 13  2  0  0  0  0
 30 32  1  0  0  0  0
M  END
>  <Mol_ID> (2,758)
2758

>  <Formula> (2,758)
C23H18ClN3O4S

>  <MolWeight> (2,758)
467.92472

>  <PCAT_CMPD_ID> (2,758)
WAY-626743

>  <CNC_ID> (2,758)
359335549

>  <transfer_container_id> (2,758)
PTN000000067

>  <COMPOUND_NUMBER> (2,758)
WAY-626743

>  <BAR_CODE_NO> (2,758)
90460952

>  <LOCATION_CODE> (2,758)
PTNCS

>  <AMOUNT_CURRENT> (2,758)
32.2

$$$$
WAY-626804
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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  4  2  1  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
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 10  5  1  0  0  0  0
 11  7  1  0  0  0  0
 12  5  2  0  0  0  0
 13  7  2  0  0  0  0
 14  8  2  0  0  0  0
 15 11  1  0  0  0  0
 16 10  1  0  0  0  0
 17  3  1  0  0  0  0
 18  9  1  0  0  0  0
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  9  4  1  0  0  0  0
 22 18  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,759)
2759

>  <Formula> (2,759)
C16H18N4O4

>  <MolWeight> (2,759)
330.33852

>  <PCAT_CMPD_ID> (2,759)
WAY-626804

>  <CNC_ID> (2,759)
359335609

>  <transfer_container_id> (2,759)
PTN000000067

>  <COMPOUND_NUMBER> (2,759)
WAY-626804

>  <BAR_CODE_NO> (2,759)
90461015

>  <LOCATION_CODE> (2,759)
PTNCS

>  <AMOUNT_CURRENT> (2,759)
33

$$$$
WAY-626856
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  5  1  2  0  0  0  0
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  8  1  1  0  0  0  0
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 10  4  2  0  0  0  0
 11  6  1  0  0  0  0
 12 15  1  0  0  0  0
 13 10  1  0  0  0  0
 14  3  2  0  0  0  0
 15  2  2  0  0  0  0
 16  5  1  0  0  0  0
 17  7  1  0  0  0  0
 18 12  1  0  0  0  0
 19 16  2  0  0  0  0
 20  8  1  0  0  0  0
 21 20  1  0  0  0  0
 21  9  1  0  0  0  0
 19 15  1  0  0  0  0
 11 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,760)
2760

>  <Formula> (2,760)
C15H15NO4S

>  <MolWeight> (2,760)
305.3489

>  <PCAT_CMPD_ID> (2,760)
WAY-626856

>  <CNC_ID> (2,760)
359335661

>  <transfer_container_id> (2,760)
PTN000000067

>  <COMPOUND_NUMBER> (2,760)
WAY-626856

>  <BAR_CODE_NO> (2,760)
90461070

>  <LOCATION_CODE> (2,760)
PTNCS

>  <AMOUNT_CURRENT> (2,760)
32.3

$$$$
WAY-626861
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 16  5  1  0  0  0  0
 17  4  1  0  0  0  0
 18  6  1  0  0  0  0
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 21 22  1  0  0  0  0
 22 17  1  0  0  0  0
 16 14  1  0  0  0  0
  7 10  2  0  0  0  0
M  END
>  <Mol_ID> (2,761)
2761

>  <Formula> (2,761)
C17H24N2O2S

>  <MolWeight> (2,761)
320.44966

>  <PCAT_CMPD_ID> (2,761)
WAY-626861

>  <CNC_ID> (2,761)
359335666

>  <transfer_container_id> (2,761)
PTN000000067

>  <COMPOUND_NUMBER> (2,761)
WAY-626861

>  <BAR_CODE_NO> (2,761)
90461075

>  <LOCATION_CODE> (2,761)
PTNCS

>  <AMOUNT_CURRENT> (2,761)
32.1

$$$$
WAY-626869
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,762)
2762

>  <Formula> (2,762)
C20H19ClN4O4S

>  <MolWeight> (2,762)
446.90726

>  <PCAT_CMPD_ID> (2,762)
WAY-626869

>  <CNC_ID> (2,762)
359335674

>  <transfer_container_id> (2,762)
PTN000000067

>  <COMPOUND_NUMBER> (2,762)
WAY-626869

>  <BAR_CODE_NO> (2,762)
90461083

>  <LOCATION_CODE> (2,762)
PTNCS

>  <AMOUNT_CURRENT> (2,762)
33

$$$$
WAY-626915
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,763)
2763

>  <Formula> (2,763)
C20H17ClN2O4S

>  <MolWeight> (2,763)
416.87798

>  <PCAT_CMPD_ID> (2,763)
WAY-626915

>  <CNC_ID> (2,763)
359335720

>  <transfer_container_id> (2,763)
PTN000000067

>  <COMPOUND_NUMBER> (2,763)
WAY-626915

>  <BAR_CODE_NO> (2,763)
90461130

>  <LOCATION_CODE> (2,763)
PTNCS

>  <AMOUNT_CURRENT> (2,763)
32

$$$$
WAY-626975
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,764)
2764

>  <Formula> (2,764)
C21H21N3O2

>  <MolWeight> (2,764)
347.41034

>  <PCAT_CMPD_ID> (2,764)
WAY-626975

>  <CNC_ID> (2,764)
359335779

>  <transfer_container_id> (2,764)
PTN000000067

>  <COMPOUND_NUMBER> (2,764)
WAY-626975

>  <BAR_CODE_NO> (2,764)
90461190

>  <LOCATION_CODE> (2,764)
PTNCS

>  <AMOUNT_CURRENT> (2,764)
32.4

$$$$
WAY-627000
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,765)
2765

>  <Formula> (2,765)
C18H18N4O2S

>  <MolWeight> (2,765)
354.42612

>  <PCAT_CMPD_ID> (2,765)
WAY-627000

>  <CNC_ID> (2,765)
359335804

>  <transfer_container_id> (2,765)
PTN000000067

>  <COMPOUND_NUMBER> (2,765)
WAY-627000

>  <BAR_CODE_NO> (2,765)
90461216

>  <LOCATION_CODE> (2,765)
PTNCS

>  <AMOUNT_CURRENT> (2,765)
32.8

$$$$
WAY-627008
csChFnd80/10111816222D

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 18  8  1  0  0  0  0
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M  END
>  <Mol_ID> (2,766)
2766

>  <Formula> (2,766)
C23H22N6O4S

>  <MolWeight> (2,766)
478.52358

>  <PCAT_CMPD_ID> (2,766)
WAY-627008

>  <CNC_ID> (2,766)
359335812

>  <transfer_container_id> (2,766)
PTN000000067

>  <COMPOUND_NUMBER> (2,766)
WAY-627008

>  <BAR_CODE_NO> (2,766)
90461224

>  <LOCATION_CODE> (2,766)
PTNCS

>  <AMOUNT_CURRENT> (2,766)
32.4

$$$$
WAY-627009
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
 11  1  1  0  0  0  0
 12 10  2  0  0  0  0
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 14  9  2  0  0  0  0
 15 11  2  0  0  0  0
 16 11  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  2  0  0  0  0
 19  9  1  0  0  0  0
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 22 10  1  0  0  0  0
 23 12  1  0  0  0  0
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 25 24  1  0  0  0  0
  3  4  1  0  0  0  0
 13 17  2  0  0  0  0
 12  6  1  0  0  0  0
 25 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,767)
2767

>  <Formula> (2,767)
C18H16N6O

>  <MolWeight> (2,767)
332.35924

>  <PCAT_CMPD_ID> (2,767)
WAY-627009

>  <CNC_ID> (2,767)
359335813

>  <transfer_container_id> (2,767)
PTN000000067

>  <COMPOUND_NUMBER> (2,767)
WAY-627009

>  <BAR_CODE_NO> (2,767)
90461225

>  <LOCATION_CODE> (2,767)
PTNCS

>  <AMOUNT_CURRENT> (2,767)
32.7

$$$$
WAY-627013
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  5  2  0  0  0  0
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 13  1  2  0  0  0  0
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 15  7  1  0  0  0  0
 16 11  1  0  0  0  0
 17  4  1  0  0  0  0
 18  9  2  0  0  0  0
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 23  8  1  0  0  0  0
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 29 30  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,768)
2768

>  <Formula> (2,768)
C23H25N3O5S

>  <MolWeight> (2,768)
455.5267

>  <PCAT_CMPD_ID> (2,768)
WAY-627013

>  <CNC_ID> (2,768)
359335817

>  <transfer_container_id> (2,768)
PTN000000067

>  <COMPOUND_NUMBER> (2,768)
WAY-627013

>  <BAR_CODE_NO> (2,768)
90461229

>  <LOCATION_CODE> (2,768)
PTNCS

>  <AMOUNT_CURRENT> (2,768)
32.6

$$$$
WAY-627018
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  4  1  1  0  0  0  0
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 10  7  1  0  0  0  0
 11  1  1  0  0  0  0
 12  8  2  0  0  0  0
 13 14  1  0  0  0  0
 14  9  2  0  0  0  0
 15  6  2  0  0  0  0
 16  6  1  0  0  0  0
 17  4  2  0  0  0  0
 18  7  2  0  0  0  0
 19 15  1  0  0  0  0
 20 16  2  0  0  0  0
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 22 15  1  0  0  0  0
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 24 20  1  0  0  0  0
  3  2  1  0  0  0  0
 21 19  2  0  0  0  0
 13 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,769)
2769

>  <Formula> (2,769)
C17H15N3O3S

>  <MolWeight> (2,769)
341.3843

>  <PCAT_CMPD_ID> (2,769)
WAY-627018

>  <CNC_ID> (2,769)
359335822

>  <transfer_container_id> (2,769)
PTN000000067

>  <COMPOUND_NUMBER> (2,769)
WAY-627018

>  <BAR_CODE_NO> (2,769)
90461234

>  <LOCATION_CODE> (2,769)
PTNCS

>  <AMOUNT_CURRENT> (2,769)
32.6

$$$$
WAY-627036
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
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 13  5  2  0  0  0  0
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 17  8  2  0  0  0  0
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 20  6  1  0  0  0  0
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  7  6  2  0  0  0  0
 22 23  1  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,770)
2770

>  <Formula> (2,770)
C15H13N3O4S

>  <MolWeight> (2,770)
331.34642

>  <PCAT_CMPD_ID> (2,770)
WAY-627036

>  <CNC_ID> (2,770)
359335840

>  <transfer_container_id> (2,770)
PTN000000067

>  <COMPOUND_NUMBER> (2,770)
WAY-627036

>  <BAR_CODE_NO> (2,770)
90461253

>  <LOCATION_CODE> (2,770)
PTNCS

>  <AMOUNT_CURRENT> (2,770)
32.3

$$$$
WAY-627048
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  1  0  0  0  0
 13 11  1  0  0  0  0
 14 10  2  0  0  0  0
 15  5  2  0  0  0  0
 16 12  1  0  0  0  0
 17 10  1  0  0  0  0
 18 16  2  0  0  0  0
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 23 18  1  0  0  0  0
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 22 18  1  0  0  0  0
 14  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,771)
2771

>  <Formula> (2,771)
C16H13N7OS

>  <MolWeight> (2,771)
351.38572

>  <PCAT_CMPD_ID> (2,771)
WAY-627048

>  <CNC_ID> (2,771)
359335852

>  <transfer_container_id> (2,771)
PTN000000067

>  <COMPOUND_NUMBER> (2,771)
WAY-627048

>  <BAR_CODE_NO> (2,771)
90461265

>  <LOCATION_CODE> (2,771)
PTNCS

>  <AMOUNT_CURRENT> (2,771)
32.7

$$$$
WAY-627050
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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  6  2  1  0  0  0  0
  7 10  1  0  0  0  0
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 10 18  1  0  0  0  0
 11  1  1  0  0  0  0
 12 11  1  0  0  0  0
 13  6  1  0  0  0  0
 14 11  2  0  0  0  0
 15  5  1  0  0  0  0
 16 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  1  0  0  0  0
 20 15  2  0  0  0  0
 21 20  1  0  0  0  0
 22 19  2  0  0  0  0
 23 21  2  0  0  0  0
  8  6  2  0  0  0  0
 16 17  2  0  0  0  0
  5  4  2  0  0  0  0
 23 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,772)
2772

>  <Formula> (2,772)
C15H10N4O2S2

>  <MolWeight> (2,772)
342.3955

>  <PCAT_CMPD_ID> (2,772)
WAY-627050

>  <CNC_ID> (2,772)
359335854

>  <transfer_container_id> (2,772)
PTN000000067

>  <COMPOUND_NUMBER> (2,772)
WAY-627050

>  <BAR_CODE_NO> (2,772)
90461267

>  <LOCATION_CODE> (2,772)
PTNCS

>  <AMOUNT_CURRENT> (2,772)
32.4

$$$$
WAY-627077
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  8  2  0  0  0  0
 11  2  1  0  0  0  0
 12  6  1  0  0  0  0
 13 20  1  0  0  0  0
 14 10  1  0  0  0  0
 15  4  2  0  0  0  0
 16  8  1  0  0  0  0
 17  9  2  0  0  0  0
 18 19  1  0  0  0  0
 19 16  2  0  0  0  0
 20  9  1  0  0  0  0
 21 14  1  0  0  0  0
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 23 21  2  0  0  0  0
 24 22  2  0  0  0  0
 11 12  2  0  0  0  0
 18 14  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,773)
2773

>  <Formula> (2,773)
C18H12N2O3S

>  <MolWeight> (2,773)
336.36448

>  <PCAT_CMPD_ID> (2,773)
WAY-627077

>  <CNC_ID> (2,773)
359335881

>  <transfer_container_id> (2,773)
PTN000000067

>  <COMPOUND_NUMBER> (2,773)
WAY-627077

>  <BAR_CODE_NO> (2,773)
90461294

>  <LOCATION_CODE> (2,773)
PTNCS

>  <AMOUNT_CURRENT> (2,773)
32.6

$$$$
WAY-627083
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12 14  1  0  0  0  0
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 15 10  2  0  0  0  0
 16 12  2  0  0  0  0
 17 18  1  0  0  0  0
 18 12  1  0  0  0  0
 19  3  1  0  0  0  0
 20  2  1  0  0  0  0
 21  5  1  0  0  0  0
 22  9  1  0  0  0  0
 23 11  1  0  0  0  0
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 25 22  2  0  0  0  0
  3  5  1  0  0  0  0
 11  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,774)
2774

>  <Formula> (2,774)
C19H20N2O3S

>  <MolWeight> (2,774)
356.4387

>  <PCAT_CMPD_ID> (2,774)
WAY-627083

>  <CNC_ID> (2,774)
359335887

>  <transfer_container_id> (2,774)
PTN000000067

>  <COMPOUND_NUMBER> (2,774)
WAY-627083

>  <BAR_CODE_NO> (2,774)
90461300

>  <LOCATION_CODE> (2,774)
PTNCS

>  <AMOUNT_CURRENT> (2,774)
32.4

$$$$
WAY-627090
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
 11  5  1  0  0  0  0
 12  5  2  0  0  0  0
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 14  9  1  0  0  0  0
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 21  7  1  0  0  0  0
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  4  7  1  0  0  0  0
 16  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,775)
2775

>  <Formula> (2,775)
C15H17N3O4

>  <MolWeight> (2,775)
303.31318

>  <PCAT_CMPD_ID> (2,775)
WAY-627090

>  <CNC_ID> (2,775)
359335894

>  <transfer_container_id> (2,775)
PTN000000067

>  <COMPOUND_NUMBER> (2,775)
WAY-627090

>  <BAR_CODE_NO> (2,775)
90461307

>  <LOCATION_CODE> (2,775)
PTNCS

>  <AMOUNT_CURRENT> (2,775)
32.4

$$$$
WAY-627168
csChFnd80/10111816222D

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 15  6  1  0  0  0  0
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 12 11  2  0  0  0  0
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M  END
>  <Mol_ID> (2,776)
2776

>  <Formula> (2,776)
C19H21N3OS

>  <MolWeight> (2,776)
339.45454

>  <PCAT_CMPD_ID> (2,776)
WAY-627168

>  <CNC_ID> (2,776)
359335972

>  <transfer_container_id> (2,776)
PTN000000067

>  <COMPOUND_NUMBER> (2,776)
WAY-627168

>  <BAR_CODE_NO> (2,776)
90461385

>  <LOCATION_CODE> (2,776)
PTNCS

>  <AMOUNT_CURRENT> (2,776)
32.4

$$$$
WAY-627176
csChFnd80/10111816222D

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 10 21  1  0  0  0  0
 11  1  1  0  0  0  0
 12  3  1  0  0  0  0
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 15 14  1  0  0  0  0
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M  END
>  <Mol_ID> (2,777)
2777

>  <Formula> (2,777)
C22H22ClNO4

>  <MolWeight> (2,777)
399.86738

>  <PCAT_CMPD_ID> (2,777)
WAY-627176

>  <CNC_ID> (2,777)
359335980

>  <transfer_container_id> (2,777)
PTN000000067

>  <COMPOUND_NUMBER> (2,777)
WAY-627176

>  <BAR_CODE_NO> (2,777)
90461393

>  <LOCATION_CODE> (2,777)
PTNCS

>  <AMOUNT_CURRENT> (2,777)
32.4

$$$$
WAY-627497
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 11 12  2  0  0  0  0
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M  END
>  <Mol_ID> (2,778)
2778

>  <Formula> (2,778)
C17H12N2O2S2

>  <MolWeight> (2,778)
340.41938

>  <PCAT_CMPD_ID> (2,778)
WAY-627497

>  <CNC_ID> (2,778)
359336301

>  <transfer_container_id> (2,778)
PTN000000067

>  <COMPOUND_NUMBER> (2,778)
WAY-627497

>  <BAR_CODE_NO> (2,778)
90461722

>  <LOCATION_CODE> (2,778)
PTNCS

>  <AMOUNT_CURRENT> (2,778)
32.3

$$$$
WAY-627507
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,779)
2779

>  <Formula> (2,779)
C17H18ClN3O4S

>  <MolWeight> (2,779)
395.86052

>  <PCAT_CMPD_ID> (2,779)
WAY-627507

>  <CNC_ID> (2,779)
359336311

>  <transfer_container_id> (2,779)
PTN000000067

>  <COMPOUND_NUMBER> (2,779)
WAY-627507

>  <BAR_CODE_NO> (2,779)
90461732

>  <LOCATION_CODE> (2,779)
PTNCS

>  <AMOUNT_CURRENT> (2,779)
32.5

$$$$
WAY-627547
csChFnd80/10111816222D

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 15 13  1  0  0  0  0
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M  END
>  <Mol_ID> (2,780)
2780

>  <Formula> (2,780)
C18H15NO3

>  <MolWeight> (2,780)
293.3166

>  <PCAT_CMPD_ID> (2,780)
WAY-627547

>  <CNC_ID> (2,780)
359336351

>  <transfer_container_id> (2,780)
PTN000000067

>  <COMPOUND_NUMBER> (2,780)
WAY-627547

>  <BAR_CODE_NO> (2,780)
90461777

>  <LOCATION_CODE> (2,780)
PTNCS

>  <AMOUNT_CURRENT> (2,780)
32.7

$$$$
WAY-627562
csChFnd80/10111816222D

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  8 13  1  0  0  0  0
  9  2  2  0  0  0  0
 10  1  1  0  0  0  0
 11  8  1  0  0  0  0
 12  8  2  0  0  0  0
 13  7  1  0  0  0  0
 14 11  1  0  0  0  0
 15  6  1  0  0  0  0
 16 14  1  0  0  0  0
 17 16  1  0  0  0  0
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 20 17  1  0  0  0  0
 21 19  1  0  0  0  0
  5  6  2  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,781)
2781

>  <Formula> (2,781)
C13H21N5O2S

>  <MolWeight> (2,781)
311.40314

>  <PCAT_CMPD_ID> (2,781)
WAY-627562

>  <CNC_ID> (2,781)
359336366

>  <transfer_container_id> (2,781)
PTN000000067

>  <COMPOUND_NUMBER> (2,781)
WAY-627562

>  <BAR_CODE_NO> (2,781)
90461793

>  <LOCATION_CODE> (2,781)
PTNCS

>  <AMOUNT_CURRENT> (2,781)
32.6

$$$$
WAY-627570
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  6  1  0  0  0  0
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 14 11  1  0  0  0  0
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 16  4  1  0  0  0  0
 17  7  1  0  0  0  0
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 21 17  2  0  0  0  0
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M  END
>  <Mol_ID> (2,782)
2782

>  <Formula> (2,782)
C17H15N3O4

>  <MolWeight> (2,782)
325.3187

>  <PCAT_CMPD_ID> (2,782)
WAY-627570

>  <CNC_ID> (2,782)
359336374

>  <transfer_container_id> (2,782)
PTN000000067

>  <COMPOUND_NUMBER> (2,782)
WAY-627570

>  <BAR_CODE_NO> (2,782)
90461801

>  <LOCATION_CODE> (2,782)
PTNCS

>  <AMOUNT_CURRENT> (2,782)
32.6

$$$$
WAY-627615
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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 19  3  1  0  0  0  0
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 12  9  2  0  0  0  0
 13 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,783)
2783

>  <Formula> (2,783)
C14H12N2OS2

>  <MolWeight> (2,783)
288.38788

>  <PCAT_CMPD_ID> (2,783)
WAY-627615

>  <CNC_ID> (2,783)
359336419

>  <transfer_container_id> (2,783)
PTN000000067

>  <COMPOUND_NUMBER> (2,783)
WAY-627615

>  <BAR_CODE_NO> (2,783)
90461848

>  <LOCATION_CODE> (2,783)
PTNCS

>  <AMOUNT_CURRENT> (2,783)
32.1

$$$$
WAY-627620
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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 16  2  2  0  0  0  0
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 22  3  1  0  0  0  0
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 26  6  1  0  0  0  0
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M  END
>  <Mol_ID> (2,784)
2784

>  <Formula> (2,784)
C17H10F3NO5

>  <MolWeight> (2,784)
365.2602096

>  <PCAT_CMPD_ID> (2,784)
WAY-627620

>  <CNC_ID> (2,784)
359336424

>  <transfer_container_id> (2,784)
PTN000000067

>  <COMPOUND_NUMBER> (2,784)
WAY-627620

>  <BAR_CODE_NO> (2,784)
90461853

>  <LOCATION_CODE> (2,784)
PTNCS

>  <AMOUNT_CURRENT> (2,784)
32.6

$$$$
WAY-627635
csChFnd80/10111816222D

 28 30  0  0  0  0  0  0  0  0999 V2000
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 11  1  2  0  0  0  0
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 17  5  1  0  0  0  0
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  3  4  2  0  0  0  0
 25 19  2  0  0  0  0
 28 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,785)
2785

>  <Formula> (2,785)
C20H27N5O3

>  <MolWeight> (2,785)
385.46008

>  <PCAT_CMPD_ID> (2,785)
WAY-627635

>  <CNC_ID> (2,785)
359336439

>  <transfer_container_id> (2,785)
PTN000000067

>  <COMPOUND_NUMBER> (2,785)
WAY-627635

>  <BAR_CODE_NO> (2,785)
90461868

>  <LOCATION_CODE> (2,785)
PTNCS

>  <AMOUNT_CURRENT> (2,785)
32.3

$$$$
WAY-627637
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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 17  1  1  0  0  0  0
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 30 29  2  0  0  0  0
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 31 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,786)
2786

>  <Formula> (2,786)
C23H22N4O2S2

>  <MolWeight> (2,786)
450.57638

>  <PCAT_CMPD_ID> (2,786)
WAY-627637

>  <CNC_ID> (2,786)
359336441

>  <transfer_container_id> (2,786)
PTN000000067

>  <COMPOUND_NUMBER> (2,786)
WAY-627637

>  <BAR_CODE_NO> (2,786)
90461870

>  <LOCATION_CODE> (2,786)
PTNCS

>  <AMOUNT_CURRENT> (2,786)
32.7

$$$$
WAY-627654
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 12  5  2  0  0  0  0
 13  6  2  0  0  0  0
 14 11  1  0  0  0  0
 15  3  1  0  0  0  0
 16  7  1  0  0  0  0
 17  8  1  0  0  0  0
 18 14  2  0  0  0  0
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M  END
>  <Mol_ID> (2,787)
2787

>  <Formula> (2,787)
C19H19N3O3

>  <MolWeight> (2,787)
337.37246

>  <PCAT_CMPD_ID> (2,787)
WAY-627654

>  <CNC_ID> (2,787)
359336458

>  <transfer_container_id> (2,787)
PTN000000067

>  <COMPOUND_NUMBER> (2,787)
WAY-627654

>  <BAR_CODE_NO> (2,787)
90461887

>  <LOCATION_CODE> (2,787)
PTNCS

>  <AMOUNT_CURRENT> (2,787)
32.5

$$$$
WAY-627661
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 13  1  2  0  0  0  0
 14  5  2  0  0  0  0
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 16  9  1  0  0  0  0
 17  8  1  0  0  0  0
 18 11  1  0  0  0  0
 19  6  1  0  0  0  0
 20  7  1  0  0  0  0
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 24 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,788)
2788

>  <Formula> (2,788)
C19H21N3O5

>  <MolWeight> (2,788)
371.38714

>  <PCAT_CMPD_ID> (2,788)
WAY-627661

>  <CNC_ID> (2,788)
359336465

>  <transfer_container_id> (2,788)
PTN000000067

>  <COMPOUND_NUMBER> (2,788)
WAY-627661

>  <BAR_CODE_NO> (2,788)
90461895

>  <LOCATION_CODE> (2,788)
PTNCS

>  <AMOUNT_CURRENT> (2,788)
32.9

$$$$
WAY-627662
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 11  6  1  0  0  0  0
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 18  8  2  0  0  0  0
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 23 22  1  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,789)
2789

>  <Formula> (2,789)
C16H16N4O3S

>  <MolWeight> (2,789)
344.38824

>  <PCAT_CMPD_ID> (2,789)
WAY-627662

>  <CNC_ID> (2,789)
359336466

>  <transfer_container_id> (2,789)
PTN000000067

>  <COMPOUND_NUMBER> (2,789)
WAY-627662

>  <BAR_CODE_NO> (2,789)
90461896

>  <LOCATION_CODE> (2,789)
PTNCS

>  <AMOUNT_CURRENT> (2,789)
32.6

$$$$
WAY-627666
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,790)
2790

>  <Formula> (2,790)
C22H27NO4

>  <MolWeight> (2,790)
369.45408

>  <PCAT_CMPD_ID> (2,790)
WAY-627666

>  <CNC_ID> (2,790)
359336470

>  <transfer_container_id> (2,790)
PTN000000067

>  <COMPOUND_NUMBER> (2,790)
WAY-627666

>  <BAR_CODE_NO> (2,790)
90461900

>  <LOCATION_CODE> (2,790)
PTNCS

>  <AMOUNT_CURRENT> (2,790)
32.1

$$$$
WAY-627689
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,791)
2791

>  <Formula> (2,791)
C23H29N3O2

>  <MolWeight> (2,791)
379.49526

>  <PCAT_CMPD_ID> (2,791)
WAY-627689

>  <CNC_ID> (2,791)
359336493

>  <transfer_container_id> (2,791)
PTN000000067

>  <COMPOUND_NUMBER> (2,791)
WAY-627689

>  <BAR_CODE_NO> (2,791)
90461923

>  <LOCATION_CODE> (2,791)
PTNCS

>  <AMOUNT_CURRENT> (2,791)
32.9

$$$$
WAY-627721
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,792)
2792

>  <Formula> (2,792)
C23H25N5O2S

>  <MolWeight> (2,792)
435.5419

>  <PCAT_CMPD_ID> (2,792)
WAY-627721

>  <CNC_ID> (2,792)
359336525

>  <transfer_container_id> (2,792)
PTN000000067

>  <COMPOUND_NUMBER> (2,792)
WAY-627721

>  <BAR_CODE_NO> (2,792)
90461955

>  <LOCATION_CODE> (2,792)
PTNCS

>  <AMOUNT_CURRENT> (2,792)
32.7

$$$$
WAY-627259
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,793)
2793

>  <Formula> (2,793)
C20H22N2O5S

>  <MolWeight> (2,793)
402.46408

>  <PCAT_CMPD_ID> (2,793)
WAY-627259

>  <CNC_ID> (2,793)
359336063

>  <transfer_container_id> (2,793)
PTN000000067

>  <COMPOUND_NUMBER> (2,793)
WAY-627259

>  <BAR_CODE_NO> (2,793)
90461477

>  <LOCATION_CODE> (2,793)
PTNCS

>  <AMOUNT_CURRENT> (2,793)
32.6

$$$$
WAY-627396
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,794)
2794

>  <Formula> (2,794)
C26H24ClN5O2

>  <MolWeight> (2,794)
473.95406

>  <PCAT_CMPD_ID> (2,794)
WAY-627396

>  <CNC_ID> (2,794)
359336200

>  <transfer_container_id> (2,794)
PTN000000067

>  <COMPOUND_NUMBER> (2,794)
WAY-627396

>  <BAR_CODE_NO> (2,794)
90461617

>  <LOCATION_CODE> (2,794)
PTNCS

>  <AMOUNT_CURRENT> (2,794)
32.9

$$$$
WAY-627420
csChFnd80/10111816222D

 33 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,795)
2795

>  <Formula> (2,795)
C22H24F3N3O5

>  <MolWeight> (2,795)
467.4382696

>  <PCAT_CMPD_ID> (2,795)
WAY-627420

>  <CNC_ID> (2,795)
359336224

>  <transfer_container_id> (2,795)
PTN000000067

>  <COMPOUND_NUMBER> (2,795)
WAY-627420

>  <BAR_CODE_NO> (2,795)
90461644

>  <LOCATION_CODE> (2,795)
PTNCS

>  <AMOUNT_CURRENT> (2,795)
32

$$$$
WAY-627423
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 13  6  1  0  0  0  0
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 21  8  1  0  0  0  0
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M  END
>  <Mol_ID> (2,796)
2796

>  <Formula> (2,796)
C14H15N3O5S

>  <MolWeight> (2,796)
337.351

>  <PCAT_CMPD_ID> (2,796)
WAY-627423

>  <CNC_ID> (2,796)
359336227

>  <transfer_container_id> (2,796)
PTN000000067

>  <COMPOUND_NUMBER> (2,796)
WAY-627423

>  <BAR_CODE_NO> (2,796)
90461647

>  <LOCATION_CODE> (2,796)
PTNCS

>  <AMOUNT_CURRENT> (2,796)
32.3

$$$$
WAY-627451
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
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M  END
>  <Mol_ID> (2,797)
2797

>  <Formula> (2,797)
C20H19NO6S2

>  <MolWeight> (2,797)
433.49796

>  <PCAT_CMPD_ID> (2,797)
WAY-627451

>  <CNC_ID> (2,797)
359336255

>  <transfer_container_id> (2,797)
PTN000000067

>  <COMPOUND_NUMBER> (2,797)
WAY-627451

>  <BAR_CODE_NO> (2,797)
90461675

>  <LOCATION_CODE> (2,797)
PTNCS

>  <AMOUNT_CURRENT> (2,797)
32.8

$$$$
WAY-627454
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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  7 14  1  0  0  0  0
  8  6  2  0  0  0  0
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 12  9  1  0  0  0  0
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 15  2  1  0  0  0  0
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 17  5  1  0  0  0  0
 18  6  1  0  0  0  0
 19  8  1  0  0  0  0
 20 13  1  0  0  0  0
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 22 15  2  0  0  0  0
 23 15  1  0  0  0  0
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 27 21  2  0  0  0  0
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 29 22  1  0  0  0  0
 30 28  1  0  0  0  0
  3  5  1  0  0  0  0
 30 29  2  0  0  0  0
 25 19  2  0  0  0  0
 26 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,798)
2798

>  <Formula> (2,798)
C23H15N3O3S

>  <MolWeight> (2,798)
413.4485

>  <PCAT_CMPD_ID> (2,798)
WAY-627454

>  <CNC_ID> (2,798)
359336258

>  <transfer_container_id> (2,798)
PTN000000067

>  <COMPOUND_NUMBER> (2,798)
WAY-627454

>  <BAR_CODE_NO> (2,798)
90461678

>  <LOCATION_CODE> (2,798)
PTNCS

>  <AMOUNT_CURRENT> (2,798)
32.9

$$$$
WAY-627456
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6 10  1  0  0  0  0
  7  2  1  0  0  0  0
  8 12  1  0  0  0  0
  9  6  2  0  0  0  0
 10 11  1  0  0  0  0
 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13  8  1  0  0  0  0
 14 19  2  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18 16  2  0  0  0  0
 19 17  1  0  0  0  0
 20  7  1  0  0  0  0
 21  7  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
  3  5  1  0  0  0  0
 24 23  1  0  0  0  0
 18 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,799)
2799

>  <Formula> (2,799)
C17H13ClN2O3S

>  <MolWeight> (2,799)
360.81472

>  <PCAT_CMPD_ID> (2,799)
WAY-627456

>  <CNC_ID> (2,799)
359336260

>  <transfer_container_id> (2,799)
PTN000000067

>  <COMPOUND_NUMBER> (2,799)
WAY-627456

>  <BAR_CODE_NO> (2,799)
90461680

>  <LOCATION_CODE> (2,799)
PTNCS

>  <AMOUNT_CURRENT> (2,799)
32.4

$$$$
WAY-627457
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  9  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
 11 12  1  0  0  0  0
 12  6  1  0  0  0  0
 13 11  1  0  0  0  0
 14 19  2  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18 16  2  0  0  0  0
 19 17  1  0  0  0  0
 20  7  1  0  0  0  0
 21  7  2  0  0  0  0
 22 21  1  0  0  0  0
 23 20  2  0  0  0  0
 24 22  2  0  0  0  0
  3  5  1  0  0  0  0
 24 23  1  0  0  0  0
 18 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,800)
2800

>  <Formula> (2,800)
C17H13BrN2O4

>  <MolWeight> (2,800)
389.20012

>  <PCAT_CMPD_ID> (2,800)
WAY-627457

>  <CNC_ID> (2,800)
359336261

>  <transfer_container_id> (2,800)
PTN000000067

>  <COMPOUND_NUMBER> (2,800)
WAY-627457

>  <BAR_CODE_NO> (2,800)
90461681

>  <LOCATION_CODE> (2,800)
PTNCS

>  <AMOUNT_CURRENT> (2,800)
33

$$$$
WAY-627483
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  5  2  0  0  0  0
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  9 11  1  0  0  0  0
 10  3  1  0  0  0  0
 11 16  2  0  0  0  0
 12  2  1  0  0  0  0
 13 23  1  0  0  0  0
 14  2  2  0  0  0  0
 15  9  1  0  0  0  0
 16  8  1  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19  6  2  0  0  0  0
 20  7  1  0  0  0  0
 21  4  1  0  0  0  0
 22  4  1  0  0  0  0
 23 24  2  0  0  0  0
 24 16  1  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
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 20 10  2  0  0  0  0
 27 25  1  0  0  0  0
 13  9  2  0  0  0  0
 18 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,801)
2801

>  <Formula> (2,801)
C20H21N3O5

>  <MolWeight> (2,801)
383.39784

>  <PCAT_CMPD_ID> (2,801)
WAY-627483

>  <CNC_ID> (2,801)
359336287

>  <transfer_container_id> (2,801)
PTN000000067

>  <COMPOUND_NUMBER> (2,801)
WAY-627483

>  <BAR_CODE_NO> (2,801)
90461708

>  <LOCATION_CODE> (2,801)
PTNCS

>  <AMOUNT_CURRENT> (2,801)
32.9

$$$$
WAY-644830
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6  7  1  0  0  0  0
  7  3  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12  6  2  0  0  0  0
 13 11  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
 16 13  1  0  0  0  0
 17 13  2  0  0  0  0
 18 14  2  0  0  0  0
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 22 20  2  0  0  0  0
  5  3  1  0  0  0  0
 19 15  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,802)
2802

>  <Formula> (2,802)
C16H15N5O

>  <MolWeight> (2,802)
293.3232

>  <PCAT_CMPD_ID> (2,802)
WAY-644830

>  <CNC_ID> (2,802)
359337502

>  <transfer_container_id> (2,802)
PTN000000067

>  <COMPOUND_NUMBER> (2,802)
WAY-644830

>  <BAR_CODE_NO> (2,802)
90479410

>  <LOCATION_CODE> (2,802)
PTNCS

>  <AMOUNT_CURRENT> (2,802)
32.6

$$$$
WAY-644842
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
    1.8042   -0.0542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  9  1  0  0  0  0
  5 12  1  0  0  0  0
  6  3  1  0  0  0  0
  7 11  1  0  0  0  0
  8  2  2  0  0  0  0
  9 14  1  0  0  0  0
 10  2  1  0  0  0  0
 11 10  2  0  0  0  0
 12  7  1  0  0  0  0
 13  5  2  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
 16  3  1  0  0  0  0
  6  8  1  0  0  0  0
  9  7  2  0  0  0  0
  5  4  1  0  0  0  0
M  END
>  <Mol_ID> (2,803)
2803

>  <Formula> (2,803)
C11H9N3OS

>  <MolWeight> (2,803)
231.27366

>  <PCAT_CMPD_ID> (2,803)
WAY-644842

>  <CNC_ID> (2,803)
359337514

>  <transfer_container_id> (2,803)
PTN000000067

>  <COMPOUND_NUMBER> (2,803)
WAY-644842

>  <BAR_CODE_NO> (2,803)
90479424

>  <LOCATION_CODE> (2,803)
PTNCS

>  <AMOUNT_CURRENT> (2,803)
32.8

$$$$
WAY-644846
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  4  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
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  7  3  1  0  0  0  0
  8 12  1  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 11  1  2  0  0  0  0
 12 10  2  0  0  0  0
 13  6  2  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16 14  1  0  0  0  0
 17 14  2  0  0  0  0
 18 17  1  0  0  0  0
 19 16  2  0  0  0  0
 20 18  2  0  0  0  0
  8  9  2  0  0  0  0
  7  5  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,804)
2804

>  <Formula> (2,804)
C16H12O4

>  <MolWeight> (2,804)
268.26408

>  <PCAT_CMPD_ID> (2,804)
WAY-644846

>  <CNC_ID> (2,804)
359337518

>  <transfer_container_id> (2,804)
PTN000000067

>  <COMPOUND_NUMBER> (2,804)
WAY-644846

>  <BAR_CODE_NO> (2,804)
90479428

>  <LOCATION_CODE> (2,804)
PTNCS

>  <AMOUNT_CURRENT> (2,804)
32.3

$$$$
WAY-644863
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
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 10  3  1  0  0  0  0
 11  5  2  0  0  0  0
 12  3  1  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  2  1  0  0  0  0
 16  4  2  0  0  0  0
 17 20  1  0  0  0  0
 18  6  2  0  0  0  0
 19  5  1  0  0  0  0
 20 19  2  0  0  0  0
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 22  7  1  0  0  0  0
 23  7  1  0  0  0  0
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 25 21  2  0  0  0  0
 26 21  1  0  0  0  0
 27 23  1  0  0  0  0
 28 22  1  0  0  0  0
 29 26  2  0  0  0  0
 30 25  1  0  0  0  0
 31 29  1  0  0  0  0
 32 27  1  0  0  0  0
 32 28  1  0  0  0  0
 17  9  2  0  0  0  0
  4  2  1  0  0  0  0
 31 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,805)
2805

>  <Formula> (2,805)
C24H29N3O4S

>  <MolWeight> (2,805)
455.56976

>  <PCAT_CMPD_ID> (2,805)
WAY-644863

>  <CNC_ID> (2,805)
359337535

>  <transfer_container_id> (2,805)
PTN000000067

>  <COMPOUND_NUMBER> (2,805)
WAY-644863

>  <BAR_CODE_NO> (2,805)
90479445

>  <LOCATION_CODE> (2,805)
PTNCS

>  <AMOUNT_CURRENT> (2,805)
32.4

$$$$
WAY-644870
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  4  2  0  0  0  0
 11  2  1  0  0  0  0
 12  5  1  0  0  0  0
 13 18  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  2  0  0  0  0
 16  7  1  0  0  0  0
 17 13  2  0  0  0  0
 18 12  1  0  0  0  0
 19  1  1  0  0  0  0
 20 15  1  0  0  0  0
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 22 21  2  0  0  0  0
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 26 20  1  0  0  0  0
  3  6  1  0  0  0  0
 23 20  2  0  0  0  0
 14  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,806)
2806

>  <Formula> (2,806)
C18H22N6OS

>  <MolWeight> (2,806)
370.47188

>  <PCAT_CMPD_ID> (2,806)
WAY-644870

>  <CNC_ID> (2,806)
359337542

>  <transfer_container_id> (2,806)
PTN000000067

>  <COMPOUND_NUMBER> (2,806)
WAY-644870

>  <BAR_CODE_NO> (2,806)
90479452

>  <LOCATION_CODE> (2,806)
PTNCS

>  <AMOUNT_CURRENT> (2,806)
32.6

$$$$
WAY-644906
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 25  9  1  0  0  0  0
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 18 24  1  0  0  0  0
  5  4  2  0  0  0  0
 28 21  2  0  0  0  0
 31 29  2  0  0  0  0
M  END
>  <Mol_ID> (2,807)
2807

>  <Formula> (2,807)
C22H24N4O4S

>  <MolWeight> (2,807)
440.51536

>  <PCAT_CMPD_ID> (2,807)
WAY-644906

>  <CNC_ID> (2,807)
359337578

>  <transfer_container_id> (2,807)
PTN000000067

>  <COMPOUND_NUMBER> (2,807)
WAY-644906

>  <BAR_CODE_NO> (2,807)
90479489

>  <LOCATION_CODE> (2,807)
PTNCS

>  <AMOUNT_CURRENT> (2,807)
32.6

$$$$
WAY-644908
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10 19  1  0  0  0  0
 11  2  1  0  0  0  0
 12  2  1  0  0  0  0
 13  3  2  0  0  0  0
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 15  6  1  0  0  0  0
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 29  7  1  0  0  0  0
 10 20  1  0  0  0  0
  5  4  2  0  0  0  0
 22 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,808)
2808

>  <Formula> (2,808)
C19H24FN5O3S

>  <MolWeight> (2,808)
421.4889632

>  <PCAT_CMPD_ID> (2,808)
WAY-644908

>  <CNC_ID> (2,808)
359337580

>  <transfer_container_id> (2,808)
PTN000000067

>  <COMPOUND_NUMBER> (2,808)
WAY-644908

>  <BAR_CODE_NO> (2,808)
90479491

>  <LOCATION_CODE> (2,808)
PTNCS

>  <AMOUNT_CURRENT> (2,808)
32.3

$$$$
WAY-644918
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 26 20  2  0  0  0  0
  3  5  2  0  0  0  0
 31 30  2  0  0  0  0
 32 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,809)
2809

>  <Formula> (2,809)
C26H22N4OS

>  <MolWeight> (2,809)
438.54408

>  <PCAT_CMPD_ID> (2,809)
WAY-644918

>  <CNC_ID> (2,809)
359337590

>  <transfer_container_id> (2,809)
PTN000000067

>  <COMPOUND_NUMBER> (2,809)
WAY-644918

>  <BAR_CODE_NO> (2,809)
90479501

>  <LOCATION_CODE> (2,809)
PTNCS

>  <AMOUNT_CURRENT> (2,809)
32.6

$$$$
WAY-644925
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 13  7  1  0  0  0  0
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 12  7  2  0  0  0  0
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M  END
>  <Mol_ID> (2,810)
2810

>  <Formula> (2,810)
C22H19ClN2O5S

>  <MolWeight> (2,810)
458.91466

>  <PCAT_CMPD_ID> (2,810)
WAY-644925

>  <CNC_ID> (2,810)
359337597

>  <transfer_container_id> (2,810)
PTN000000067

>  <COMPOUND_NUMBER> (2,810)
WAY-644925

>  <BAR_CODE_NO> (2,810)
90479508

>  <LOCATION_CODE> (2,810)
PTNCS

>  <AMOUNT_CURRENT> (2,810)
32.9

$$$$
WAY-644963
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 23 20  2  0  0  0  0
 13 12  2  0  0  0  0
M  END
>  <Mol_ID> (2,811)
2811

>  <Formula> (2,811)
C16H14N2O4S

>  <MolWeight> (2,811)
330.35836

>  <PCAT_CMPD_ID> (2,811)
WAY-644963

>  <CNC_ID> (2,811)
359337635

>  <transfer_container_id> (2,811)
PTN000000067

>  <COMPOUND_NUMBER> (2,811)
WAY-644963

>  <BAR_CODE_NO> (2,811)
90479547

>  <LOCATION_CODE> (2,811)
PTNCS

>  <AMOUNT_CURRENT> (2,811)
32.1

$$$$
WAY-645069
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,812)
2812

>  <Formula> (2,812)
C18H20BrN3O

>  <MolWeight> (2,812)
374.2749

>  <PCAT_CMPD_ID> (2,812)
WAY-645069

>  <CNC_ID> (2,812)
359337741

>  <transfer_container_id> (2,812)
PTN000000067

>  <COMPOUND_NUMBER> (2,812)
WAY-645069

>  <BAR_CODE_NO> (2,812)
90479654

>  <LOCATION_CODE> (2,812)
PTNCS

>  <AMOUNT_CURRENT> (2,812)
32.4

$$$$
WAY-645098
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,813)
2813

>  <Formula> (2,813)
C16H14FN5OS

>  <MolWeight> (2,813)
343.3786632

>  <PCAT_CMPD_ID> (2,813)
WAY-645098

>  <CNC_ID> (2,813)
359337770

>  <transfer_container_id> (2,813)
PTN000000067

>  <COMPOUND_NUMBER> (2,813)
WAY-645098

>  <BAR_CODE_NO> (2,813)
90479683

>  <LOCATION_CODE> (2,813)
PTNCS

>  <AMOUNT_CURRENT> (2,813)
33

$$$$
WAY-645129
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,814)
2814

>  <Formula> (2,814)
C23H23N3O5

>  <MolWeight> (2,814)
421.44582

>  <PCAT_CMPD_ID> (2,814)
WAY-645129

>  <CNC_ID> (2,814)
359337801

>  <transfer_container_id> (2,814)
PTN000000067

>  <COMPOUND_NUMBER> (2,814)
WAY-645129

>  <BAR_CODE_NO> (2,814)
90479714

>  <LOCATION_CODE> (2,814)
PTNCS

>  <AMOUNT_CURRENT> (2,814)
32.6

$$$$
WAY-645187
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,815)
2815

>  <Formula> (2,815)
C18H22FN3O2S

>  <MolWeight> (2,815)
363.4495832

>  <PCAT_CMPD_ID> (2,815)
WAY-645187

>  <CNC_ID> (2,815)
359337859

>  <transfer_container_id> (2,815)
PTN000000067

>  <COMPOUND_NUMBER> (2,815)
WAY-645187

>  <BAR_CODE_NO> (2,815)
90479774

>  <LOCATION_CODE> (2,815)
PTNCS

>  <AMOUNT_CURRENT> (2,815)
32.4

$$$$
WAY-645192
csChFnd80/10111816222D

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 10  2  2  0  0  0  0
 11  5  2  0  0  0  0
 12  2  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  2  0  0  0  0
 15 20  1  0  0  0  0
 16  4  1  0  0  0  0
 17  3  1  0  0  0  0
 18  3  1  0  0  0  0
 19  5  1  0  0  0  0
 20 22  1  0  0  0  0
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 25 23  1  0  0  0  0
 25 24  1  0  0  0  0
  9  6  2  0  0  0  0
 21 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,816)
2816

>  <Formula> (2,816)
C17H26N4O3S

>  <MolWeight> (2,816)
366.47834

>  <PCAT_CMPD_ID> (2,816)
WAY-645192

>  <CNC_ID> (2,816)
359337864

>  <transfer_container_id> (2,816)
PTN000000067

>  <COMPOUND_NUMBER> (2,816)
WAY-645192

>  <BAR_CODE_NO> (2,816)
90479779

>  <LOCATION_CODE> (2,816)
PTNCS

>  <AMOUNT_CURRENT> (2,816)
32.5

$$$$
WAY-645202
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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  7 10  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10  8  2  0  0  0  0
 11 13  1  0  0  0  0
 12  6  1  0  0  0  0
 13 22  1  0  0  0  0
 14  1  2  0  0  0  0
 15  1  2  0  0  0  0
 16 17  1  0  0  0  0
 17  1  1  0  0  0  0
 18  6  1  0  0  0  0
 19  7  2  0  0  0  0
 20 12  1  0  0  0  0
 21 12  2  0  0  0  0
 22 20  1  0  0  0  0
 23 13  2  0  0  0  0
 24  8  1  0  0  0  0
 25 10  1  0  0  0  0
 26 18  1  0  0  0  0
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 28 26  1  0  0  0  0
 29 30  1  0  0  0  0
 30 24  2  0  0  0  0
 16  9  1  0  0  0  0
  7  4  1  0  0  0  0
 29 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,817)
2817

>  <Formula> (2,817)
C20H25N3O6S

>  <MolWeight> (2,817)
435.494

>  <PCAT_CMPD_ID> (2,817)
WAY-645202

>  <CNC_ID> (2,817)
359337874

>  <transfer_container_id> (2,817)
PTN000000067

>  <COMPOUND_NUMBER> (2,817)
WAY-645202

>  <BAR_CODE_NO> (2,817)
90479789

>  <LOCATION_CODE> (2,817)
PTNCS

>  <AMOUNT_CURRENT> (2,817)
32.1

$$$$
WAY-645316
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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  8 16  2  0  0  0  0
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 10  1  1  0  0  0  0
 11 20  1  0  0  0  0
 12  9  1  0  0  0  0
 13  7  1  0  0  0  0
 14  6  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  1  0  0  0  0
 18  6  2  0  0  0  0
 19  9  2  0  0  0  0
 20 23  2  0  0  0  0
 21 14  1  0  0  0  0
 22  4  1  0  0  0  0
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 24  5  1  0  0  0  0
 25 10  1  0  0  0  0
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 29 27  2  0  0  0  0
  2  5  1  0  0  0  0
 29 28  1  0  0  0  0
 11  7  2  0  0  0  0
 17 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,818)
2818

>  <Formula> (2,818)
C21H19N3O5

>  <MolWeight> (2,818)
393.39266

>  <PCAT_CMPD_ID> (2,818)
WAY-645316

>  <CNC_ID> (2,818)
359337988

>  <transfer_container_id> (2,818)
PTN000000067

>  <COMPOUND_NUMBER> (2,818)
WAY-645316

>  <BAR_CODE_NO> (2,818)
90479904

>  <LOCATION_CODE> (2,818)
PTNCS

>  <AMOUNT_CURRENT> (2,818)
32.7

$$$$
WAY-645323
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10 14  1  0  0  0  0
 11  7  1  0  0  0  0
 12 21  1  0  0  0  0
 13 10  2  0  0  0  0
 14  8  1  0  0  0  0
 15 12  2  0  0  0  0
 16 10  1  0  0  0  0
 17  9  2  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20  7  1  0  0  0  0
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 26 25  1  0  0  0  0
  3  5  1  0  0  0  0
 18 11  2  0  0  0  0
 26 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,819)
2819

>  <Formula> (2,819)
C19H25N5OS

>  <MolWeight> (2,819)
371.4997

>  <PCAT_CMPD_ID> (2,819)
WAY-645323

>  <CNC_ID> (2,819)
359337995

>  <transfer_container_id> (2,819)
PTN000000067

>  <COMPOUND_NUMBER> (2,819)
WAY-645323

>  <BAR_CODE_NO> (2,819)
90479911

>  <LOCATION_CODE> (2,819)
PTNCS

>  <AMOUNT_CURRENT> (2,819)
32.5

$$$$
WAY-645332
csChFnd80/10111816222D

 34 37  0  0  0  0  0  0  0  0999 V2000
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 18  2  2  0  0  0  0
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 26  8  1  0  0  0  0
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 30 21  1  0  0  0  0
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 33 28  1  0  0  0  0
 34 33  1  0  0  0  0
 11 25  2  0  0  0  0
 13  8  2  0  0  0  0
 16  5  1  0  0  0  0
 31 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,820)
2820

>  <Formula> (2,820)
C24H23F2N3O4S

>  <MolWeight> (2,820)
487.5189264

>  <PCAT_CMPD_ID> (2,820)
WAY-645332

>  <CNC_ID> (2,820)
359338004

>  <transfer_container_id> (2,820)
PTN000000067

>  <COMPOUND_NUMBER> (2,820)
WAY-645332

>  <BAR_CODE_NO> (2,820)
90479920

>  <LOCATION_CODE> (2,820)
PTNCS

>  <AMOUNT_CURRENT> (2,820)
32.8

$$$$
WAY-645428
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  5  1  0  0  0  0
 12  1  1  0  0  0  0
 13  3  1  0  0  0  0
 14 13  1  0  0  0  0
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 16 14  1  0  0  0  0
 17  6  2  0  0  0  0
 18 12  1  0  0  0  0
 19  9  2  0  0  0  0
 20 14  2  0  0  0  0
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 23 12  2  0  0  0  0
 24  2  1  0  0  0  0
 25  7  1  0  0  0  0
 26  8  1  0  0  0  0
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 28 27  1  0  0  0  0
  8  4  1  0  0  0  0
 28 26  2  0  0  0  0
  6  3  1  0  0  0  0
 21 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,821)
2821

>  <Formula> (2,821)
C21H20N2O5

>  <MolWeight> (2,821)
380.3939

>  <PCAT_CMPD_ID> (2,821)
WAY-645428

>  <CNC_ID> (2,821)
359338100

>  <transfer_container_id> (2,821)
PTN000000067

>  <COMPOUND_NUMBER> (2,821)
WAY-645428

>  <BAR_CODE_NO> (2,821)
90480016

>  <LOCATION_CODE> (2,821)
PTNCS

>  <AMOUNT_CURRENT> (2,821)
32.7

$$$$
WAY-645498
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  3  1  1  0  0  0  0
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 10  9  1  0  0  0  0
 11  6  1  0  0  0  0
 12  2  2  0  0  0  0
 13  2  1  0  0  0  0
 14  5  1  0  0  0  0
 15 18  1  0  0  0  0
 16  6  1  0  0  0  0
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 20  3  1  0  0  0  0
 21  3  1  0  0  0  0
 22 21  1  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
 24 23  1  0  0  0  0
  9  4  2  0  0  0  0
 15 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,822)
2822

>  <Formula> (2,822)
C16H16BrFN2O3S

>  <MolWeight> (2,822)
415.2772432

>  <PCAT_CMPD_ID> (2,822)
WAY-645498

>  <CNC_ID> (2,822)
359338170

>  <transfer_container_id> (2,822)
PTN000000067

>  <COMPOUND_NUMBER> (2,822)
WAY-645498

>  <BAR_CODE_NO> (2,822)
90480089

>  <LOCATION_CODE> (2,822)
PTNCS

>  <AMOUNT_CURRENT> (2,822)
32.1

$$$$
WAY-645522
csChFnd80/10111816222D

 30 32  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  1  2  0  0  0  0
 12  3  2  0  0  0  0
 13  4  1  0  0  0  0
 14  4  1  0  0  0  0
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 17  8  2  0  0  0  0
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 23  7  1  0  0  0  0
 24  9  1  0  0  0  0
 25  8  1  0  0  0  0
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 30 28  2  0  0  0  0
 16  6  1  0  0  0  0
 27 18  2  0  0  0  0
 21 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,823)
2823

>  <Formula> (2,823)
C20H22ClN3O5S

>  <MolWeight> (2,823)
451.92378

>  <PCAT_CMPD_ID> (2,823)
WAY-645522

>  <CNC_ID> (2,823)
359338194

>  <transfer_container_id> (2,823)
PTN000000067

>  <COMPOUND_NUMBER> (2,823)
WAY-645522

>  <BAR_CODE_NO> (2,823)
90480114

>  <LOCATION_CODE> (2,823)
PTNCS

>  <AMOUNT_CURRENT> (2,823)
32.2

$$$$
WAY-645570
csChFnd80/10111816222D

 30 33  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
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 15  9  1  0  0  0  0
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 17  5  2  0  0  0  0
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 10  8  2  0  0  0  0
 14 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,824)
2824

>  <Formula> (2,824)
C23H22N2O5

>  <MolWeight> (2,824)
406.43118

>  <PCAT_CMPD_ID> (2,824)
WAY-645570

>  <CNC_ID> (2,824)
359338242

>  <transfer_container_id> (2,824)
PTN000000067

>  <COMPOUND_NUMBER> (2,824)
WAY-645570

>  <BAR_CODE_NO> (2,824)
90480163

>  <LOCATION_CODE> (2,824)
PTNCS

>  <AMOUNT_CURRENT> (2,824)
32.9

$$$$
WAY-645576
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,825)
2825

>  <Formula> (2,825)
C25H25N5O5

>  <MolWeight> (2,825)
475.4965

>  <PCAT_CMPD_ID> (2,825)
WAY-645576

>  <CNC_ID> (2,825)
359338248

>  <transfer_container_id> (2,825)
PTN000000067

>  <COMPOUND_NUMBER> (2,825)
WAY-645576

>  <BAR_CODE_NO> (2,825)
90480169

>  <LOCATION_CODE> (2,825)
PTNCS

>  <AMOUNT_CURRENT> (2,825)
32.1

$$$$
WAY-645605
csChFnd80/10111816222D

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 12  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,826)
2826

>  <Formula> (2,826)
C19H23FN2O2S

>  <MolWeight> (2,826)
362.4615232

>  <PCAT_CMPD_ID> (2,826)
WAY-645605

>  <CNC_ID> (2,826)
359338277

>  <transfer_container_id> (2,826)
PTN000000067

>  <COMPOUND_NUMBER> (2,826)
WAY-645605

>  <BAR_CODE_NO> (2,826)
90480198

>  <LOCATION_CODE> (2,826)
PTNCS

>  <AMOUNT_CURRENT> (2,826)
32.6

$$$$
WAY-645700
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,827)
2827

>  <Formula> (2,827)
C17H15N3O5

>  <MolWeight> (2,827)
341.3181

>  <PCAT_CMPD_ID> (2,827)
WAY-645700

>  <CNC_ID> (2,827)
359338372

>  <transfer_container_id> (2,827)
PTN000000067

>  <COMPOUND_NUMBER> (2,827)
WAY-645700

>  <BAR_CODE_NO> (2,827)
90480294

>  <LOCATION_CODE> (2,827)
PTNCS

>  <AMOUNT_CURRENT> (2,827)
32.5

$$$$
WAY-645786
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,828)
2828

>  <Formula> (2,828)
C21H20N4O2

>  <MolWeight> (2,828)
360.4091

>  <PCAT_CMPD_ID> (2,828)
WAY-645786

>  <CNC_ID> (2,828)
359338458

>  <transfer_container_id> (2,828)
PTN000000067

>  <COMPOUND_NUMBER> (2,828)
WAY-645786

>  <BAR_CODE_NO> (2,828)
90480381

>  <LOCATION_CODE> (2,828)
PTNCS

>  <AMOUNT_CURRENT> (2,828)
32.3

$$$$
WAY-645789
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
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 10  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,829)
2829

>  <Formula> (2,829)
C8H8N2S2

>  <MolWeight> (2,829)
196.29252

>  <PCAT_CMPD_ID> (2,829)
WAY-645789

>  <CNC_ID> (2,829)
359338461

>  <transfer_container_id> (2,829)
PTN000000067

>  <COMPOUND_NUMBER> (2,829)
WAY-645789

>  <BAR_CODE_NO> (2,829)
90480384

>  <LOCATION_CODE> (2,829)
PTNCS

>  <AMOUNT_CURRENT> (2,829)
32.4

$$$$
WAY-645791
csChFnd80/10111816222D

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 10  3  1  0  0  0  0
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M  END
>  <Mol_ID> (2,830)
2830

>  <Formula> (2,830)
C16H20ClN3O2S

>  <MolWeight> (2,830)
353.8669

>  <PCAT_CMPD_ID> (2,830)
WAY-645791

>  <CNC_ID> (2,830)
359338463

>  <transfer_container_id> (2,830)
PTN000000067

>  <COMPOUND_NUMBER> (2,830)
WAY-645791

>  <BAR_CODE_NO> (2,830)
90480386

>  <LOCATION_CODE> (2,830)
PTNCS

>  <AMOUNT_CURRENT> (2,830)
32.6

$$$$
WAY-645792
csChFnd80/10111816222D

 15 16  0  0  1  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,831)
2831

>  <Formula> (2,831)
C10H11NO4

>  <MolWeight> (2,831)
209.19864

>  <PCAT_CMPD_ID> (2,831)
WAY-645792

>  <CNC_ID> (2,831)
359338464

>  <transfer_container_id> (2,831)
PTN000000067

>  <COMPOUND_NUMBER> (2,831)
WAY-645792

>  <BAR_CODE_NO> (2,831)
90480387

>  <LOCATION_CODE> (2,831)
PTNCS

>  <AMOUNT_CURRENT> (2,831)
32.8

$$$$
WAY-645854
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,832)
2832

>  <Formula> (2,832)
C20H20ClNO6S

>  <MolWeight> (2,832)
437.8939

>  <PCAT_CMPD_ID> (2,832)
WAY-645854

>  <CNC_ID> (2,832)
359338526

>  <transfer_container_id> (2,832)
PTN000000067

>  <COMPOUND_NUMBER> (2,832)
WAY-645854

>  <BAR_CODE_NO> (2,832)
90480450

>  <LOCATION_CODE> (2,832)
PTNCS

>  <AMOUNT_CURRENT> (2,832)
33

$$$$
WAY-645855
csChFnd80/10111816222D

 29 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,833)
2833

>  <Formula> (2,833)
C22H22N2O4S

>  <MolWeight> (2,833)
410.48608

>  <PCAT_CMPD_ID> (2,833)
WAY-645855

>  <CNC_ID> (2,833)
359338527

>  <transfer_container_id> (2,833)
PTN000000067

>  <COMPOUND_NUMBER> (2,833)
WAY-645855

>  <BAR_CODE_NO> (2,833)
90480451

>  <LOCATION_CODE> (2,833)
PTNCS

>  <AMOUNT_CURRENT> (2,833)
32.8

$$$$
WAY-645869
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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  8  7  2  0  0  0  0
  9  4  2  0  0  0  0
 10  3  2  0  0  0  0
 11 12  1  0  0  0  0
 12  8  1  0  0  0  0
 13  7  1  0  0  0  0
 14  8  1  0  0  0  0
 15 13  2  0  0  0  0
 16  9  1  0  0  0  0
 17 19  1  0  0  0  0
 18 15  1  0  0  0  0
 19 14  2  0  0  0  0
  6  9  1  0  0  0  0
 18 12  2  0  0  0  0
 17 11  2  0  0  0  0
M  END
>  <Mol_ID> (2,834)
2834

>  <Formula> (2,834)
C14H11N3O2

>  <MolWeight> (2,834)
253.25604

>  <PCAT_CMPD_ID> (2,834)
WAY-645869

>  <CNC_ID> (2,834)
359338541

>  <transfer_container_id> (2,834)
PTN000000067

>  <COMPOUND_NUMBER> (2,834)
WAY-645869

>  <BAR_CODE_NO> (2,834)
90480466

>  <LOCATION_CODE> (2,834)
PTNCS

>  <AMOUNT_CURRENT> (2,834)
32.4

$$$$
WAY-645876
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
   -3.0583   -0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  6  1  0  0  0  0
  4 16  1  0  0  0  0
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  8  2  1  0  0  0  0
  9  1  1  0  0  0  0
 10  1  1  0  0  0  0
 11  1  1  0  0  0  0
 12  3  1  0  0  0  0
 13 10  1  0  0  0  0
 14  9  1  0  0  0  0
 15 11  1  0  0  0  0
 16  7  1  0  0  0  0
 17  3  2  0  0  0  0
 18  8  1  0  0  0  0
 19  2  2  0  0  0  0
 20  5  2  0  0  0  0
 21  4  2  0  0  0  0
 22 13  1  0  0  0  0
 23 15  1  0  0  0  0
 24 15  1  0  0  0  0
 25 17  1  0  0  0  0
 26 12  2  0  0  0  0
 27 25  2  0  0  0  0
 28 26  1  0  0  0  0
 29 17  1  0  0  0  0
 30  7  1  0  0  0  0
 31 29  1  0  0  0  0
 24 14  1  0  0  0  0
 13 23  1  0  0  0  0
 22 14  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,835)
2835

>  <Formula> (2,835)
C23H30ClN3O4

>  <MolWeight> (2,835)
447.955

>  <PCAT_CMPD_ID> (2,835)
WAY-645876

>  <CNC_ID> (2,835)
359338548

>  <transfer_container_id> (2,835)
PTN000000067

>  <COMPOUND_NUMBER> (2,835)
WAY-645876

>  <BAR_CODE_NO> (2,835)
90480473

>  <LOCATION_CODE> (2,835)
PTNCS

>  <AMOUNT_CURRENT> (2,835)
32.4

$$$$
WAY-645929
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
    2.4250   -1.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  6  2  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7 12  1  0  0  0  0
  8  4  1  0  0  0  0
  9  4  2  0  0  0  0
 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 13 17  2  0  0  0  0
 14 23  1  0  0  0  0
 15 13  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 14  1  0  0  0  0
 19 14  2  0  0  0  0
 20 11  1  0  0  0  0
 21  5  1  0  0  0  0
 22  6  1  0  0  0  0
 23 20  1  0  0  0  0
  3  2  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,836)
2836

>  <Formula> (2,836)
C16H17ClN2O4

>  <MolWeight> (2,836)
336.77018

>  <PCAT_CMPD_ID> (2,836)
WAY-645929

>  <CNC_ID> (2,836)
359338602

>  <transfer_container_id> (2,836)
PTN000000067

>  <COMPOUND_NUMBER> (2,836)
WAY-645929

>  <BAR_CODE_NO> (2,836)
90480526

>  <LOCATION_CODE> (2,836)
PTNCS

>  <AMOUNT_CURRENT> (2,836)
33

$$$$
WAY-645933
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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  2  6  2  0  0  0  0
  3  5  1  0  0  0  0
  4  1  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  2  0  0  0  0
  9  7  1  0  0  0  0
 10  4  1  0  0  0  0
 11  8  1  0  0  0  0
 12  7  2  0  0  0  0
 13 10  1  0  0  0  0
 14  4  2  0  0  0  0
 15 17  2  0  0  0  0
 16 11  2  0  0  0  0
 17 12  1  0  0  0  0
 18 12  1  0  0  0  0
 19  5  1  0  0  0  0
 20  6  1  0  0  0  0
 21 11  1  0  0  0  0
 22 18  1  0  0  0  0
  3  2  1  0  0  0  0
  8 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,837)
2837

>  <Formula> (2,837)
C16H17NO5

>  <MolWeight> (2,837)
303.30988

>  <PCAT_CMPD_ID> (2,837)
WAY-645933

>  <CNC_ID> (2,837)
359338606

>  <transfer_container_id> (2,837)
PTN000000067

>  <COMPOUND_NUMBER> (2,837)
WAY-645933

>  <BAR_CODE_NO> (2,837)
90480530

>  <LOCATION_CODE> (2,837)
PTNCS

>  <AMOUNT_CURRENT> (2,837)
27.98

$$$$
WAY-645966
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11  8  2  0  0  0  0
 12  8  1  0  0  0  0
 13  9  2  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16  9  1  0  0  0  0
 17 13  1  0  0  0  0
 18 12  2  0  0  0  0
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 20 13  1  0  0  0  0
 21 16  2  0  0  0  0
 22 18  1  0  0  0  0
 23 21  1  0  0  0  0
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 25 24  1  0  0  0  0
  4  5  1  0  0  0  0
 23 20  2  0  0  0  0
 25 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,838)
2838

>  <Formula> (2,838)
C18H17N5O2

>  <MolWeight> (2,838)
335.35988

>  <PCAT_CMPD_ID> (2,838)
WAY-645966

>  <CNC_ID> (2,838)
359338639

>  <transfer_container_id> (2,838)
PTN000000067

>  <COMPOUND_NUMBER> (2,838)
WAY-645966

>  <BAR_CODE_NO> (2,838)
90480563

>  <LOCATION_CODE> (2,838)
PTNCS

>  <AMOUNT_CURRENT> (2,838)
33

$$$$
WAY-645967
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 11  8  2  0  0  0  0
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 14  6  1  0  0  0  0
 15  8  1  0  0  0  0
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M  END
>  <Mol_ID> (2,839)
2839

>  <Formula> (2,839)
C18H23N5O2

>  <MolWeight> (2,839)
341.40752

>  <PCAT_CMPD_ID> (2,839)
WAY-645967

>  <CNC_ID> (2,839)
359338640

>  <transfer_container_id> (2,839)
PTN000000067

>  <COMPOUND_NUMBER> (2,839)
WAY-645967

>  <BAR_CODE_NO> (2,839)
90480564

>  <LOCATION_CODE> (2,839)
PTNCS

>  <AMOUNT_CURRENT> (2,839)
32.6

$$$$
WAY-645970
csChFnd80/10111816222D

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 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12 14  2  0  0  0  0
 13 17  1  0  0  0  0
 14  8  1  0  0  0  0
 15 11  2  0  0  0  0
 16  4  1  0  0  0  0
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 18 12  1  0  0  0  0
 19  6  1  0  0  0  0
 12  6  1  0  0  0  0
 10  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,840)
2840

>  <Formula> (2,840)
C10H8Cl2N4OS2

>  <MolWeight> (2,840)
335.23272

>  <PCAT_CMPD_ID> (2,840)
WAY-645970

>  <CNC_ID> (2,840)
359338643

>  <transfer_container_id> (2,840)
PTN000000067

>  <COMPOUND_NUMBER> (2,840)
WAY-645970

>  <BAR_CODE_NO> (2,840)
90480567

>  <LOCATION_CODE> (2,840)
PTNCS

>  <AMOUNT_CURRENT> (2,840)
32.3

$$$$
WAY-645989
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  1  0  0  0  0
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 16  9  2  0  0  0  0
 17 11  2  0  0  0  0
 18  5  1  0  0  0  0
 19  7  1  0  0  0  0
 20  8  1  0  0  0  0
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 25 24  1  0  0  0  0
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 25 23  2  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,841)
2841

>  <Formula> (2,841)
C17H18N6O2

>  <MolWeight> (2,841)
338.36382

>  <PCAT_CMPD_ID> (2,841)
WAY-645989

>  <CNC_ID> (2,841)
359338662

>  <transfer_container_id> (2,841)
PTN000000067

>  <COMPOUND_NUMBER> (2,841)
WAY-645989

>  <BAR_CODE_NO> (2,841)
90480586

>  <LOCATION_CODE> (2,841)
PTNCS

>  <AMOUNT_CURRENT> (2,841)
32.5

$$$$
WAY-646006
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15  2  1  0  0  0  0
 16  2  1  0  0  0  0
 17  7  1  0  0  0  0
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 19  3  2  0  0  0  0
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 21  8  1  0  0  0  0
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 20  6  1  0  0  0  0
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 26 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,842)
2842

>  <Formula> (2,842)
C19H20N2O4S2

>  <MolWeight> (2,842)
404.5031

>  <PCAT_CMPD_ID> (2,842)
WAY-646006

>  <CNC_ID> (2,842)
359338679

>  <transfer_container_id> (2,842)
PTN000000067

>  <COMPOUND_NUMBER> (2,842)
WAY-646006

>  <BAR_CODE_NO> (2,842)
90480603

>  <LOCATION_CODE> (2,842)
PTNCS

>  <AMOUNT_CURRENT> (2,842)
32.8

$$$$
WAY-646031
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  7  1  0  0  0  0
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 13  8  2  0  0  0  0
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M  END
>  <Mol_ID> (2,843)
2843

>  <Formula> (2,843)
C22H21NO6

>  <MolWeight> (2,843)
395.40524

>  <PCAT_CMPD_ID> (2,843)
WAY-646031

>  <CNC_ID> (2,843)
359338704

>  <transfer_container_id> (2,843)
PTN000000067

>  <COMPOUND_NUMBER> (2,843)
WAY-646031

>  <BAR_CODE_NO> (2,843)
90480628

>  <LOCATION_CODE> (2,843)
PTNCS

>  <AMOUNT_CURRENT> (2,843)
32.7

$$$$
WAY-646041
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 16 18  1  0  0  0  0
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M  END
>  <Mol_ID> (2,844)
2844

>  <Formula> (2,844)
C19H27N5OS

>  <MolWeight> (2,844)
373.51558

>  <PCAT_CMPD_ID> (2,844)
WAY-646041

>  <CNC_ID> (2,844)
359338714

>  <transfer_container_id> (2,844)
PTN000000067

>  <COMPOUND_NUMBER> (2,844)
WAY-646041

>  <BAR_CODE_NO> (2,844)
90480638

>  <LOCATION_CODE> (2,844)
PTNCS

>  <AMOUNT_CURRENT> (2,844)
32.6

$$$$
WAY-646042
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 13  1  0  0  0  0
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 13 15  2  0  0  0  0
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  7 10  1  0  0  0  0
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 19 21  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,845)
2845

>  <Formula> (2,845)
C20H19N5

>  <MolWeight> (2,845)
329.39836

>  <PCAT_CMPD_ID> (2,845)
WAY-646042

>  <CNC_ID> (2,845)
359338715

>  <transfer_container_id> (2,845)
PTN000000067

>  <COMPOUND_NUMBER> (2,845)
WAY-646042

>  <BAR_CODE_NO> (2,845)
90480639

>  <LOCATION_CODE> (2,845)
PTNCS

>  <AMOUNT_CURRENT> (2,845)
32.8

$$$$
WAY-646055
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,846)
2846

>  <Formula> (2,846)
C25H21FN2O2S

>  <MolWeight> (2,846)
432.5098432

>  <PCAT_CMPD_ID> (2,846)
WAY-646055

>  <CNC_ID> (2,846)
359338728

>  <transfer_container_id> (2,846)
PTN000000067

>  <COMPOUND_NUMBER> (2,846)
WAY-646055

>  <BAR_CODE_NO> (2,846)
90480652

>  <LOCATION_CODE> (2,846)
PTNCS

>  <AMOUNT_CURRENT> (2,846)
32.2

$$$$
WAY-646058
csChFnd80/10111816222D

 27 31  0  0  0  0  0  0  0  0999 V2000
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 12  2  1  0  0  0  0
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M  END
>  <Mol_ID> (2,847)
2847

>  <Formula> (2,847)
C20H28N2O3S2

>  <MolWeight> (2,847)
408.57792

>  <PCAT_CMPD_ID> (2,847)
WAY-646058

>  <CNC_ID> (2,847)
359338731

>  <transfer_container_id> (2,847)
PTN000000067

>  <COMPOUND_NUMBER> (2,847)
WAY-646058

>  <BAR_CODE_NO> (2,847)
90480655

>  <LOCATION_CODE> (2,847)
PTNCS

>  <AMOUNT_CURRENT> (2,847)
32.8

$$$$
WAY-646090
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10 15  1  0  0  0  0
 11  5  2  0  0  0  0
 12  9  1  0  0  0  0
 13  8  1  0  0  0  0
 14  3  1  0  0  0  0
 15 13  2  0  0  0  0
 16  4  1  0  0  0  0
 17  4  1  0  0  0  0
 18 19  1  0  0  0  0
 19  7  2  0  0  0  0
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 18 14  2  0  0  0  0
 20 10  2  0  0  0  0
M  END
>  <Mol_ID> (2,848)
2848

>  <Formula> (2,848)
C17H18N2O3

>  <MolWeight> (2,848)
298.33642

>  <PCAT_CMPD_ID> (2,848)
WAY-646090

>  <CNC_ID> (2,848)
359338763

>  <transfer_container_id> (2,848)
PTN000000067

>  <COMPOUND_NUMBER> (2,848)
WAY-646090

>  <BAR_CODE_NO> (2,848)
90480687

>  <LOCATION_CODE> (2,848)
PTNCS

>  <AMOUNT_CURRENT> (2,848)
32.9

$$$$
WAY-646092
csChFnd80/10111816222D

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 10  3  1  0  0  0  0
 11  3  1  0  0  0  0
 12  4  1  0  0  0  0
 13  4  2  0  0  0  0
 14 11  1  0  0  0  0
 15 10  1  0  0  0  0
 16  6  2  0  0  0  0
 17  5  2  0  0  0  0
 18 13  1  0  0  0  0
 19  6  1  0  0  0  0
 20  2  2  0  0  0  0
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  7 15  1  0  0  0  0
 23 16  1  0  0  0  0
 25 24  1  0  0  0  0
M  END
>  <Mol_ID> (2,849)
2849

>  <Formula> (2,849)
C15H16Cl2N2O5S

>  <MolWeight> (2,849)
407.26894

>  <PCAT_CMPD_ID> (2,849)
WAY-646092

>  <CNC_ID> (2,849)
359338765

>  <transfer_container_id> (2,849)
PTN000000067

>  <COMPOUND_NUMBER> (2,849)
WAY-646092

>  <BAR_CODE_NO> (2,849)
90480689

>  <LOCATION_CODE> (2,849)
PTNCS

>  <AMOUNT_CURRENT> (2,849)
32.6

$$$$
WAY-646126
csChFnd80/10111816222D

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 10 16  1  0  0  0  0
 11  4  1  0  0  0  0
 12  1  1  0  0  0  0
 13  2  1  0  0  0  0
 14  7  1  0  0  0  0
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 24 28  1  0  0  0  0
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 31 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,850)
2850

>  <Formula> (2,850)
C23H21FN4O2S

>  <MolWeight> (2,850)
436.5018432

>  <PCAT_CMPD_ID> (2,850)
WAY-646126

>  <CNC_ID> (2,850)
359338799

>  <transfer_container_id> (2,850)
PTN000000067

>  <COMPOUND_NUMBER> (2,850)
WAY-646126

>  <BAR_CODE_NO> (2,850)
90480723

>  <LOCATION_CODE> (2,850)
PTNCS

>  <AMOUNT_CURRENT> (2,850)
32.2

$$$$
WAY-646129
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
 11  2  1  0  0  0  0
 12  1  1  0  0  0  0
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 14  7  1  0  0  0  0
 15  8  2  0  0  0  0
 16  7  2  0  0  0  0
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 27 24  2  0  0  0  0
  6  3  1  0  0  0  0
M  END
>  <Mol_ID> (2,851)
2851

>  <Formula> (2,851)
C18H19N3O5S

>  <MolWeight> (2,851)
389.42556

>  <PCAT_CMPD_ID> (2,851)
WAY-646129

>  <CNC_ID> (2,851)
359338802

>  <transfer_container_id> (2,851)
PTN000000067

>  <COMPOUND_NUMBER> (2,851)
WAY-646129

>  <BAR_CODE_NO> (2,851)
90480726

>  <LOCATION_CODE> (2,851)
PTNCS

>  <AMOUNT_CURRENT> (2,851)
29.2

$$$$
WAY-646152
csChFnd80/10111816222D

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  6  5  1  0  0  0  0
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 11  8  1  0  0  0  0
 23 30  2  0  0  0  0
M  END
>  <Mol_ID> (2,852)
2852

>  <Formula> (2,852)
C24H25N5O4S

>  <MolWeight> (2,852)
479.5514

>  <PCAT_CMPD_ID> (2,852)
WAY-646152

>  <CNC_ID> (2,852)
359338825

>  <transfer_container_id> (2,852)
PTN000000067

>  <COMPOUND_NUMBER> (2,852)
WAY-646152

>  <BAR_CODE_NO> (2,852)
90480749

>  <LOCATION_CODE> (2,852)
PTNCS

>  <AMOUNT_CURRENT> (2,852)
32.7

$$$$
WAY-646156
csChFnd80/10111816222D

 29 31  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 12  3  1  0  0  0  0
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 17  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,853)
2853

>  <Formula> (2,853)
C19H21N3O6S

>  <MolWeight> (2,853)
419.45154

>  <PCAT_CMPD_ID> (2,853)
WAY-646156

>  <CNC_ID> (2,853)
359338829

>  <transfer_container_id> (2,853)
PTN000000067

>  <COMPOUND_NUMBER> (2,853)
WAY-646156

>  <BAR_CODE_NO> (2,853)
90480753

>  <LOCATION_CODE> (2,853)
PTNCS

>  <AMOUNT_CURRENT> (2,853)
32.8

$$$$
WAY-646160
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 23  1  0  0  0  0
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 15  9  2  0  0  0  0
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 17  9  1  0  0  0  0
 18 14  2  0  0  0  0
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 21  8  1  0  0  0  0
 22  8  1  0  0  0  0
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 10 11  2  0  0  0  0
 20 24  1  0  0  0  0
  6  5  2  0  0  0  0
 19 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,854)
2854

>  <Formula> (2,854)
C15H15N5O3S2

>  <MolWeight> (2,854)
377.4413

>  <PCAT_CMPD_ID> (2,854)
WAY-646160

>  <CNC_ID> (2,854)
359338833

>  <transfer_container_id> (2,854)
PTN000000067

>  <COMPOUND_NUMBER> (2,854)
WAY-646160

>  <BAR_CODE_NO> (2,854)
90480757

>  <LOCATION_CODE> (2,854)
PTNCS

>  <AMOUNT_CURRENT> (2,854)
32.9

$$$$
WAY-646194
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 11  2  1  0  0  0  0
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 13  7  1  0  0  0  0
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 16  1  1  0  0  0  0
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 22 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,855)
2855

>  <Formula> (2,855)
C20H17N3OS2

>  <MolWeight> (2,855)
379.49848

>  <PCAT_CMPD_ID> (2,855)
WAY-646194

>  <CNC_ID> (2,855)
359338867

>  <transfer_container_id> (2,855)
PTN000000067

>  <COMPOUND_NUMBER> (2,855)
WAY-646194

>  <BAR_CODE_NO> (2,855)
90480791

>  <LOCATION_CODE> (2,855)
PTNCS

>  <AMOUNT_CURRENT> (2,855)
32.5

$$$$
WAY-646232
csChFnd80/10111816222D

 33 37  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,856)
2856

>  <Formula> (2,856)
C25H23N5O3

>  <MolWeight> (2,856)
441.48182

>  <PCAT_CMPD_ID> (2,856)
WAY-646232

>  <CNC_ID> (2,856)
359338905

>  <transfer_container_id> (2,856)
PTN000000067

>  <COMPOUND_NUMBER> (2,856)
WAY-646232

>  <BAR_CODE_NO> (2,856)
90480829

>  <LOCATION_CODE> (2,856)
PTNCS

>  <AMOUNT_CURRENT> (2,856)
32.1

$$$$
WAY-646260
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,857)
2857

>  <Formula> (2,857)
C15H15F2N3O2S

>  <MolWeight> (2,857)
339.3603064

>  <PCAT_CMPD_ID> (2,857)
WAY-646260

>  <CNC_ID> (2,857)
359338933

>  <transfer_container_id> (2,857)
PTN000000067

>  <COMPOUND_NUMBER> (2,857)
WAY-646260

>  <BAR_CODE_NO> (2,857)
90480861

>  <LOCATION_CODE> (2,857)
PTNCS

>  <AMOUNT_CURRENT> (2,857)
32.7

$$$$
WAY-646320
csChFnd80/10111816222D

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 18 14  2  0  0  0  0
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M  END
>  <Mol_ID> (2,858)
2858

>  <Formula> (2,858)
C16H20N2O2

>  <MolWeight> (2,858)
272.3422

>  <PCAT_CMPD_ID> (2,858)
WAY-646320

>  <CNC_ID> (2,858)
359338993

>  <transfer_container_id> (2,858)
PTN000000067

>  <COMPOUND_NUMBER> (2,858)
WAY-646320

>  <BAR_CODE_NO> (2,858)
90480922

>  <LOCATION_CODE> (2,858)
PTNCS

>  <AMOUNT_CURRENT> (2,858)
32.6

$$$$
WAY-646351
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 18 16  2  0  0  0  0
  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (2,859)
2859

>  <Formula> (2,859)
C14H15N5OS2

>  <MolWeight> (2,859)
333.4318

>  <PCAT_CMPD_ID> (2,859)
WAY-646351

>  <CNC_ID> (2,859)
359339024

>  <transfer_container_id> (2,859)
PTN000000067

>  <COMPOUND_NUMBER> (2,859)
WAY-646351

>  <BAR_CODE_NO> (2,859)
90480953

>  <LOCATION_CODE> (2,859)
PTNCS

>  <AMOUNT_CURRENT> (2,859)
32.4

$$$$
WAY-646391
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,860)
2860

>  <Formula> (2,860)
C20H15N3OS3

>  <MolWeight> (2,860)
409.5476

>  <PCAT_CMPD_ID> (2,860)
WAY-646391

>  <CNC_ID> (2,860)
359339064

>  <transfer_container_id> (2,860)
PTN000000067

>  <COMPOUND_NUMBER> (2,860)
WAY-646391

>  <BAR_CODE_NO> (2,860)
90480995

>  <LOCATION_CODE> (2,860)
PTNCS

>  <AMOUNT_CURRENT> (2,860)
32

$$$$
WAY-646406
csChFnd80/10111816222D

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 10 18  1  0  0  0  0
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M  END
>  <Mol_ID> (2,861)
2861

>  <Formula> (2,861)
C19H16ClF4N5O

>  <MolWeight> (2,861)
441.8098528

>  <PCAT_CMPD_ID> (2,861)
WAY-646406

>  <CNC_ID> (2,861)
359339079

>  <transfer_container_id> (2,861)
PTN000000067

>  <COMPOUND_NUMBER> (2,861)
WAY-646406

>  <BAR_CODE_NO> (2,861)
90481011

>  <LOCATION_CODE> (2,861)
PTNCS

>  <AMOUNT_CURRENT> (2,861)
33

$$$$
WAY-646413
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,862)
2862

>  <Formula> (2,862)
C22H21N5O3

>  <MolWeight> (2,862)
403.43384

>  <PCAT_CMPD_ID> (2,862)
WAY-646413

>  <CNC_ID> (2,862)
359339086

>  <transfer_container_id> (2,862)
PTN000000067

>  <COMPOUND_NUMBER> (2,862)
WAY-646413

>  <BAR_CODE_NO> (2,862)
90481018

>  <LOCATION_CODE> (2,862)
PTNCS

>  <AMOUNT_CURRENT> (2,862)
32.6

$$$$
WAY-646416
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,863)
2863

>  <Formula> (2,863)
C24H23NO6

>  <MolWeight> (2,863)
421.44252

>  <PCAT_CMPD_ID> (2,863)
WAY-646416

>  <CNC_ID> (2,863)
359339089

>  <transfer_container_id> (2,863)
PTN000000067

>  <COMPOUND_NUMBER> (2,863)
WAY-646416

>  <BAR_CODE_NO> (2,863)
90481021

>  <LOCATION_CODE> (2,863)
PTNCS

>  <AMOUNT_CURRENT> (2,863)
32.8

$$$$
WAY-646435
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,864)
2864

>  <Formula> (2,864)
C22H24N4O3

>  <MolWeight> (2,864)
392.45096

>  <PCAT_CMPD_ID> (2,864)
WAY-646435

>  <CNC_ID> (2,864)
359339108

>  <transfer_container_id> (2,864)
PTN000000067

>  <COMPOUND_NUMBER> (2,864)
WAY-646435

>  <BAR_CODE_NO> (2,864)
90481040

>  <LOCATION_CODE> (2,864)
PTNCS

>  <AMOUNT_CURRENT> (2,864)
32.2

$$$$
WAY-646457
csChFnd80/10111816222D

 28 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,865)
2865

>  <Formula> (2,865)
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>  <MolWeight> (2,865)
394.44362

>  <PCAT_CMPD_ID> (2,865)
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>  <CNC_ID> (2,865)
359339130

>  <transfer_container_id> (2,865)
PTN000000067

>  <COMPOUND_NUMBER> (2,865)
WAY-646457

>  <BAR_CODE_NO> (2,865)
90481062

>  <LOCATION_CODE> (2,865)
PTNCS

>  <AMOUNT_CURRENT> (2,865)
32.5

$$$$
WAY-646458
csChFnd80/10111816222D

 20 23  0  0  0  0  0  0  0  0999 V2000
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 16  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,866)
2866

>  <Formula> (2,866)
C16H10N2O2

>  <MolWeight> (2,866)
262.2628

>  <PCAT_CMPD_ID> (2,866)
WAY-646458

>  <CNC_ID> (2,866)
359339131

>  <transfer_container_id> (2,866)
PTN000000067

>  <COMPOUND_NUMBER> (2,866)
WAY-646458

>  <BAR_CODE_NO> (2,866)
90481063

>  <LOCATION_CODE> (2,866)
PTNCS

>  <AMOUNT_CURRENT> (2,866)
32.1

$$$$
WAY-646469
csChFnd80/10111816222D

 23 24  0  0  0  0  0  0  0  0999 V2000
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 10  6  1  0  0  0  0
 11  6  2  0  0  0  0
 12  8  2  0  0  0  0
 13  9  1  0  0  0  0
 14 13  1  0  0  0  0
 15  4  1  0  0  0  0
 16  5  1  0  0  0  0
 17 21  1  0  0  0  0
 18 17  1  0  0  0  0
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 20 14  1  0  0  0  0
 21 20  2  0  0  0  0
 22 19  1  0  0  0  0
 23  9  1  0  0  0  0
  3  2  1  0  0  0  0
 17 22  2  0  0  0  0
M  END
>  <Mol_ID> (2,867)
2867

>  <Formula> (2,867)
C15H17FN4O3

>  <MolWeight> (2,867)
320.3188832

>  <PCAT_CMPD_ID> (2,867)
WAY-646469

>  <CNC_ID> (2,867)
359339142

>  <transfer_container_id> (2,867)
PTN000000067

>  <COMPOUND_NUMBER> (2,867)
WAY-646469

>  <BAR_CODE_NO> (2,867)
90481074

>  <LOCATION_CODE> (2,867)
PTNCS

>  <AMOUNT_CURRENT> (2,867)
32.9

$$$$
WAY-646520
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  5  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  1  0  0  0  0
 14 12  1  0  0  0  0
 15  8  2  0  0  0  0
 16 15  1  0  0  0  0
 17 15  1  0  0  0  0
 18  6  1  0  0  0  0
 19  6  1  0  0  0  0
 20 19  1  0  0  0  0
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 22 20  1  0  0  0  0
 13 14  2  0  0  0  0
 11 16  2  0  0  0  0
 22 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,868)
2868

>  <Formula> (2,868)
C15H17ClN2O2S2

>  <MolWeight> (2,868)
356.89068

>  <PCAT_CMPD_ID> (2,868)
WAY-646520

>  <CNC_ID> (2,868)
359339193

>  <transfer_container_id> (2,868)
PTN000000067

>  <COMPOUND_NUMBER> (2,868)
WAY-646520

>  <BAR_CODE_NO> (2,868)
90481128

>  <LOCATION_CODE> (2,868)
PTNCS

>  <AMOUNT_CURRENT> (2,868)
32

$$$$
WAY-646522
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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 13  6  1  0  0  0  0
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 16  9  2  0  0  0  0
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 17 13  2  0  0  0  0
  8  3  2  0  0  0  0
 23 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,869)
2869

>  <Formula> (2,869)
C17H20BrN3O2

>  <MolWeight> (2,869)
378.2636

>  <PCAT_CMPD_ID> (2,869)
WAY-646522

>  <CNC_ID> (2,869)
359339195

>  <transfer_container_id> (2,869)
PTN000000067

>  <COMPOUND_NUMBER> (2,869)
WAY-646522

>  <BAR_CODE_NO> (2,869)
90481130

>  <LOCATION_CODE> (2,869)
PTNCS

>  <AMOUNT_CURRENT> (2,869)
33

$$$$
WAY-646877
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,870)
2870

>  <Formula> (2,870)
C10H9ClN4OS2

>  <MolWeight> (2,870)
300.78766

>  <PCAT_CMPD_ID> (2,870)
WAY-646877

>  <CNC_ID> (2,870)
359339550

>  <transfer_container_id> (2,870)
PTN000000067

>  <COMPOUND_NUMBER> (2,870)
WAY-646877

>  <BAR_CODE_NO> (2,870)
90481491

>  <LOCATION_CODE> (2,870)
PTNCS

>  <AMOUNT_CURRENT> (2,870)
32.9

$$$$
WAY-646943
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,871)
2871

>  <Formula> (2,871)
C21H20N2O4

>  <MolWeight> (2,871)
364.3945

>  <PCAT_CMPD_ID> (2,871)
WAY-646943

>  <CNC_ID> (2,871)
359339616

>  <transfer_container_id> (2,871)
PTN000000067

>  <COMPOUND_NUMBER> (2,871)
WAY-646943

>  <BAR_CODE_NO> (2,871)
90481557

>  <LOCATION_CODE> (2,871)
PTNCS

>  <AMOUNT_CURRENT> (2,871)
32.2

$$$$
WAY-646951
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,872)
2872

>  <Formula> (2,872)
C20H20N6O2S

>  <MolWeight> (2,872)
408.4768

>  <PCAT_CMPD_ID> (2,872)
WAY-646951

>  <CNC_ID> (2,872)
359339624

>  <transfer_container_id> (2,872)
PTN000000067

>  <COMPOUND_NUMBER> (2,872)
WAY-646951

>  <BAR_CODE_NO> (2,872)
90481565

>  <LOCATION_CODE> (2,872)
PTNCS

>  <AMOUNT_CURRENT> (2,872)
32.3

$$$$
WAY-646958
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 16  6  2  0  0  0  0
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 14 13  1  0  0  0  0
 17 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,873)
2873

>  <Formula> (2,873)
C16H16N2O3S2

>  <MolWeight> (2,873)
348.43984

>  <PCAT_CMPD_ID> (2,873)
WAY-646958

>  <CNC_ID> (2,873)
359339631

>  <transfer_container_id> (2,873)
PTN000000067

>  <COMPOUND_NUMBER> (2,873)
WAY-646958

>  <BAR_CODE_NO> (2,873)
90481572

>  <LOCATION_CODE> (2,873)
PTNCS

>  <AMOUNT_CURRENT> (2,873)
32

$$$$
WAY-646979
csChFnd80/10111816222D

 21 24  0  0  0  0  0  0  0  0999 V2000
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 16  6  1  0  0  0  0
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 16  5  1  0  0  0  0
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 14  5  1  0  0  0  0
M  END
>  <Mol_ID> (2,874)
2874

>  <Formula> (2,874)
C18H22INO

>  <MolWeight> (2,874)
395.27785

>  <PCAT_CMPD_ID> (2,874)
WAY-646979

>  <CNC_ID> (2,874)
359339652

>  <transfer_container_id> (2,874)
PTN000000067

>  <COMPOUND_NUMBER> (2,874)
WAY-646979

>  <BAR_CODE_NO> (2,874)
90481593

>  <LOCATION_CODE> (2,874)
PTNCS

>  <AMOUNT_CURRENT> (2,874)
32.4

$$$$
WAY-646993
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,875)
2875

>  <Formula> (2,875)
C21H20N2O4

>  <MolWeight> (2,875)
364.3945

>  <PCAT_CMPD_ID> (2,875)
WAY-646993

>  <CNC_ID> (2,875)
359339666

>  <transfer_container_id> (2,875)
PTN000000067

>  <COMPOUND_NUMBER> (2,875)
WAY-646993

>  <BAR_CODE_NO> (2,875)
90481607

>  <LOCATION_CODE> (2,875)
PTNCS

>  <AMOUNT_CURRENT> (2,875)
32.7

$$$$
WAY-646995
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  8  1  0  0  0  0
  4  1  1  0  0  0  0
  5  7  2  0  0  0  0
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 10  7  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
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 15  1  2  0  0  0  0
 16 13  2  0  0  0  0
 17  6  1  0  0  0  0
 18 13  1  0  0  0  0
 19  4  1  0  0  0  0
 20  8  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  2  0  0  0  0
 23 22  1  0  0  0  0
 24 21  1  0  0  0  0
  3  6  2  0  0  0  0
 23 20  2  0  0  0  0
 12  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,876)
2876

>  <Formula> (2,876)
C16H15N3O3S2

>  <MolWeight> (2,876)
361.4386

>  <PCAT_CMPD_ID> (2,876)
WAY-646995

>  <CNC_ID> (2,876)
359339668

>  <transfer_container_id> (2,876)
PTN000000067

>  <COMPOUND_NUMBER> (2,876)
WAY-646995

>  <BAR_CODE_NO> (2,876)
90481609

>  <LOCATION_CODE> (2,876)
PTNCS

>  <AMOUNT_CURRENT> (2,876)
32.8

$$$$
WAY-646625
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
    0.9089    1.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  2  1  0  0  0  0
 10  1  1  0  0  0  0
 17  2  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  2  0  0  0  0
  8 12  2  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  2  0  0  0  0
 19 21  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,877)
2877

>  <Formula> (2,877)
C16H15N3O2

>  <MolWeight> (2,877)
281.3092

>  <PCAT_CMPD_ID> (2,877)
WAY-646625

>  <CNC_ID> (2,877)
359339298

>  <transfer_container_id> (2,877)
PTN000000067

>  <COMPOUND_NUMBER> (2,877)
WAY-646625

>  <BAR_CODE_NO> (2,877)
90481234

>  <LOCATION_CODE> (2,877)
PTNCS

>  <AMOUNT_CURRENT> (2,877)
32.3

$$$$
WAY-646755
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
 11  8  1  0  0  0  0
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 14  4  1  0  0  0  0
 15 18  1  0  0  0  0
 16  5  1  0  0  0  0
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 18 17  2  0  0  0  0
 19 20  1  0  0  0  0
 20 16  2  0  0  0  0
  4  2  1  0  0  0  0
 19 14  2  0  0  0  0
 15  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,878)
2878

>  <Formula> (2,878)
C16H15N3O

>  <MolWeight> (2,878)
265.3098

>  <PCAT_CMPD_ID> (2,878)
WAY-646755

>  <CNC_ID> (2,878)
359339428

>  <transfer_container_id> (2,878)
PTN000000067

>  <COMPOUND_NUMBER> (2,878)
WAY-646755

>  <BAR_CODE_NO> (2,878)
90481368

>  <LOCATION_CODE> (2,878)
PTNCS

>  <AMOUNT_CURRENT> (2,878)
32.8

$$$$
CL-207134
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 18 21  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  2  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,879)
2879

>  <Formula> (2,879)
C15H15N3O2S

>  <MolWeight> (2,879)
301.3635

>  <PCAT_CMPD_ID> (2,879)
CL-207134

>  <CNC_ID> (2,879)
359339842

>  <transfer_container_id> (2,879)
PTN000000068

>  <COMPOUND_NUMBER> (2,879)
CL-207134

>  <BAR_CODE_NO> (2,879)
390585

>  <LOCATION_CODE> (2,879)
PTNCS

>  <AMOUNT_CURRENT> (2,879)
32.5

$$$$
CL-392670
csChFnd80/10111816222D

 14 16  0  0  0  0  0  0  0  0999 V2000
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 13 14  1  0  0  0  0
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  9 13  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (2,880)
2880

>  <Formula> (2,880)
C10H10N2OS

>  <MolWeight> (2,880)
206.2642

>  <PCAT_CMPD_ID> (2,880)
CL-392670

>  <CNC_ID> (2,880)
359339871

>  <transfer_container_id> (2,880)
PTN000000068

>  <COMPOUND_NUMBER> (2,880)
CL-392670

>  <BAR_CODE_NO> (2,880)
90446145

>  <LOCATION_CODE> (2,880)
PTNCS

>  <AMOUNT_CURRENT> (2,880)
32.3

$$$$
CL-430380
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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 18 20  1  0  0  0  0
  8  9  1  0  0  0  0
 10 12  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,881)
2881

>  <Formula> (2,881)
C16H14N2O2

>  <MolWeight> (2,881)
266.29456

>  <PCAT_CMPD_ID> (2,881)
CL-430380

>  <CNC_ID> (2,881)
359339960

>  <transfer_container_id> (2,881)
PTN000000068

>  <COMPOUND_NUMBER> (2,881)
CL-430380

>  <BAR_CODE_NO> (2,881)
90446204

>  <LOCATION_CODE> (2,881)
PTNCS

>  <AMOUNT_CURRENT> (2,881)
32.6

$$$$
SD-95898
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
   -4.8214    0.1297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  9  1  0  0  0  0
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 10 11  1  0  0  0  0
  1 12  2  0  0  0  0
 13 14  1  0  0  0  0
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 16 17  1  0  0  0  0
 17 11  1  0  0  0  0
 11 13  1  0  0  0  0
 15 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Mol_ID> (2,882)
2882

>  <Formula> (2,882)
C14H20N2O6

>  <MolWeight> (2,882)
312.3184

>  <PCAT_CMPD_ID> (2,882)
SD-95898

>  <CNC_ID> (2,882)
359340007

>  <transfer_container_id> (2,882)
PTN000000068

>  <COMPOUND_NUMBER> (2,882)
SD-95898

>  <BAR_CODE_NO> (2,882)
90446077

>  <LOCATION_CODE> (2,882)
PTNCS

>  <AMOUNT_CURRENT> (2,882)
32.5

$$$$
WAY-273146
csChFnd80/10111816222D

 36 40  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
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 15  3  1  0  0  0  0
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 17  7  2  0  0  0  0
 18 10  1  0  0  0  0
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 36 35  1  0  0  0  0
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  7  8  1  0  0  0  0
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 34 28  1  0  0  0  0
 30 36  2  0  0  0  0
M  END
>  <Mol_ID> (2,883)
2883

>  <Formula> (2,883)
C27H26N4O5

>  <MolWeight> (2,883)
486.51914

>  <PCAT_CMPD_ID> (2,883)
WAY-273146

>  <CNC_ID> (2,883)
359340425

>  <transfer_container_id> (2,883)
PTN000000068

>  <COMPOUND_NUMBER> (2,883)
WAY-273146

>  <BAR_CODE_NO> (2,883)
391090

>  <LOCATION_CODE> (2,883)
PTNCS

>  <AMOUNT_CURRENT> (2,883)
32.5

$$$$
WAY-273175
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  7  2  0  0  0  0
 13 10  1  0  0  0  0
 14 11  2  0  0  0  0
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 16 13  1  0  0  0  0
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 18 16  1  0  0  0  0
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 21 19  1  0  0  0  0
  8  9  2  0  0  0  0
  6  7  1  0  0  0  0
 21 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,884)
2884

>  <Formula> (2,884)
C15H16N4OS

>  <MolWeight> (2,884)
300.37874

>  <PCAT_CMPD_ID> (2,884)
WAY-273175

>  <CNC_ID> (2,884)
359340454

>  <transfer_container_id> (2,884)
PTN000000068

>  <COMPOUND_NUMBER> (2,884)
WAY-273175

>  <BAR_CODE_NO> (2,884)
391119

>  <LOCATION_CODE> (2,884)
PTNCS

>  <AMOUNT_CURRENT> (2,884)
29.2

$$$$
WAY-273235
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
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 22 20  1  0  0  0  0
  8  9  2  0  0  0  0
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 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,885)
2885

>  <Formula> (2,885)
C16H18N4OS

>  <MolWeight> (2,885)
314.40532

>  <PCAT_CMPD_ID> (2,885)
WAY-273235

>  <CNC_ID> (2,885)
359340507

>  <transfer_container_id> (2,885)
PTN000000068

>  <COMPOUND_NUMBER> (2,885)
WAY-273235

>  <BAR_CODE_NO> (2,885)
391179

>  <LOCATION_CODE> (2,885)
PTNCS

>  <AMOUNT_CURRENT> (2,885)
32.5

$$$$
WAY-273263
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
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  9  8  2  0  0  0  0
  7  6  1  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,886)
2886

>  <Formula> (2,886)
C14H13FN4OS

>  <MolWeight> (2,886)
304.3426232

>  <PCAT_CMPD_ID> (2,886)
WAY-273263

>  <CNC_ID> (2,886)
359340532

>  <transfer_container_id> (2,886)
PTN000000068

>  <COMPOUND_NUMBER> (2,886)
WAY-273263

>  <BAR_CODE_NO> (2,886)
391207

>  <LOCATION_CODE> (2,886)
PTNCS

>  <AMOUNT_CURRENT> (2,886)
32.5

$$$$
WAY-273314
csChFnd80/10111816222D

 31 35  0  0  0  0  0  0  0  0999 V2000
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 10 11  2  0  0  0  0
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 12  4  1  0  0  0  0
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 16  7  2  0  0  0  0
 17  9  2  0  0  0  0
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 21  5  1  0  0  0  0
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  8  9  1  0  0  0  0
  5  4  1  0  0  0  0
 26 24  1  0  0  0  0
 15 14  2  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (2,887)
2887

>  <Formula> (2,887)
C21H24N6O3S

>  <MolWeight> (2,887)
440.51866

>  <PCAT_CMPD_ID> (2,887)
WAY-273314

>  <CNC_ID> (2,887)
359340583

>  <transfer_container_id> (2,887)
PTN000000068

>  <COMPOUND_NUMBER> (2,887)
WAY-273314

>  <BAR_CODE_NO> (2,887)
391258

>  <LOCATION_CODE> (2,887)
PTNCS

>  <AMOUNT_CURRENT> (2,887)
32.5

$$$$
WAY-273325
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
    3.3792   -4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 14 15  2  0  0  0  0
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M  END
>  <Mol_ID> (2,888)
2888

>  <Formula> (2,888)
C22H26N6O3S

>  <MolWeight> (2,888)
454.54524

>  <PCAT_CMPD_ID> (2,888)
WAY-273325

>  <CNC_ID> (2,888)
359340594

>  <transfer_container_id> (2,888)
PTN000000068

>  <COMPOUND_NUMBER> (2,888)
WAY-273325

>  <BAR_CODE_NO> (2,888)
391269

>  <LOCATION_CODE> (2,888)
PTNCS

>  <AMOUNT_CURRENT> (2,888)
32.5

$$$$
WAY-273335
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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  9  5  1  0  0  0  0
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 24 14  1  0  0  0  0
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M  END
>  <Mol_ID> (2,889)
2889

>  <Formula> (2,889)
C20H28N8O2S

>  <MolWeight> (2,889)
444.55372

>  <PCAT_CMPD_ID> (2,889)
WAY-273335

>  <CNC_ID> (2,889)
359340604

>  <transfer_container_id> (2,889)
PTN000000068

>  <COMPOUND_NUMBER> (2,889)
WAY-273335

>  <BAR_CODE_NO> (2,889)
391279

>  <LOCATION_CODE> (2,889)
PTNCS

>  <AMOUNT_CURRENT> (2,889)
32.5

$$$$
WAY-273348
csChFnd80/10111816222D

 18 20  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  5  1  0  0  0  0
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 14  9  2  0  0  0  0
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  2  5  1  0  0  0  0
 11 15  2  0  0  0  0
 18 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,890)
2890

>  <Formula> (2,890)
C16H15NS

>  <MolWeight> (2,890)
253.362

>  <PCAT_CMPD_ID> (2,890)
WAY-273348

>  <CNC_ID> (2,890)
359340617

>  <transfer_container_id> (2,890)
PTN000000068

>  <COMPOUND_NUMBER> (2,890)
WAY-273348

>  <BAR_CODE_NO> (2,890)
391292

>  <LOCATION_CODE> (2,890)
PTNCS

>  <AMOUNT_CURRENT> (2,890)
32.5

$$$$
WAY-273399
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,891)
2891

>  <Formula> (2,891)
C23H19ClN4O2S

>  <MolWeight> (2,891)
450.94056

>  <PCAT_CMPD_ID> (2,891)
WAY-273399

>  <CNC_ID> (2,891)
359340668

>  <transfer_container_id> (2,891)
PTN000000068

>  <COMPOUND_NUMBER> (2,891)
WAY-273399

>  <BAR_CODE_NO> (2,891)
391343

>  <LOCATION_CODE> (2,891)
PTNCS

>  <AMOUNT_CURRENT> (2,891)
32.5

$$$$
WAY-273431
csChFnd80/10111816222D

 17 19  0  0  0  0  0  0  0  0999 V2000
   -3.1500    2.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  6  1  0  0  0  0
 17 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,892)
2892

>  <Formula> (2,892)
C11H8FN5

>  <MolWeight> (2,892)
229.2131232

>  <PCAT_CMPD_ID> (2,892)
WAY-273431

>  <CNC_ID> (2,892)
359340700

>  <transfer_container_id> (2,892)
PTN000000068

>  <COMPOUND_NUMBER> (2,892)
WAY-273431

>  <BAR_CODE_NO> (2,892)
391375

>  <LOCATION_CODE> (2,892)
PTNCS

>  <AMOUNT_CURRENT> (2,892)
32.5

$$$$
WAY-273437
csChFnd80/10111816222D

 16 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,893)
2893

>  <Formula> (2,893)
C10H13N5O

>  <MolWeight> (2,893)
219.24312

>  <PCAT_CMPD_ID> (2,893)
WAY-273437

>  <CNC_ID> (2,893)
359340706

>  <transfer_container_id> (2,893)
PTN000000068

>  <COMPOUND_NUMBER> (2,893)
WAY-273437

>  <BAR_CODE_NO> (2,893)
391383

>  <LOCATION_CODE> (2,893)
PTNCS

>  <AMOUNT_CURRENT> (2,893)
32.5

$$$$
WAY-273439
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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M  END
>  <Mol_ID> (2,894)
2894

>  <Formula> (2,894)
C15H17N5O2

>  <MolWeight> (2,894)
299.32778

>  <PCAT_CMPD_ID> (2,894)
WAY-273439

>  <CNC_ID> (2,894)
359340708

>  <transfer_container_id> (2,894)
PTN000000068

>  <COMPOUND_NUMBER> (2,894)
WAY-273439

>  <BAR_CODE_NO> (2,894)
391385

>  <LOCATION_CODE> (2,894)
PTNCS

>  <AMOUNT_CURRENT> (2,894)
32.5

$$$$
WAY-273492
csChFnd80/10111816222D

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 23 24  1  0  0  0  0
 13 19  1  0  0  0  0
 28 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,895)
2895

>  <Formula> (2,895)
C20H23N3O3S2

>  <MolWeight> (2,895)
417.54492

>  <PCAT_CMPD_ID> (2,895)
WAY-273492

>  <CNC_ID> (2,895)
359340761

>  <transfer_container_id> (2,895)
PTN000000068

>  <COMPOUND_NUMBER> (2,895)
WAY-273492

>  <BAR_CODE_NO> (2,895)
391437

>  <LOCATION_CODE> (2,895)
PTNCS

>  <AMOUNT_CURRENT> (2,895)
32.5

$$$$
WAY-273524
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
    5.8750   -9.0167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  2  0  0  0  0
  6  4  2  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  3  2  0  0  0  0
 11 16  1  0  0  0  0
 12 11  1  0  0  0  0
 13  7  2  0  0  0  0
 14  6  1  0  0  0  0
 15 11  2  0  0  0  0
 16  8  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
 19 13  1  0  0  0  0
 20  7  1  0  0  0  0
 21 13  1  0  0  0  0
 22 19  1  0  0  0  0
 23 18  1  0  0  0  0
 24 18  1  0  0  0  0
 25 20  2  0  0  0  0
 26 25  1  0  0  0  0
 27 23  1  0  0  0  0
 28 24  1  0  0  0  0
 29 28  1  0  0  0  0
  6  5  1  0  0  0  0
 26 21  2  0  0  0  0
 14 17  1  0  0  0  0
 29 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,896)
2896

>  <Formula> (2,896)
C21H25N3O3S2

>  <MolWeight> (2,896)
431.5715

>  <PCAT_CMPD_ID> (2,896)
WAY-273524

>  <CNC_ID> (2,896)
359340793

>  <transfer_container_id> (2,896)
PTN000000068

>  <COMPOUND_NUMBER> (2,896)
WAY-273524

>  <BAR_CODE_NO> (2,896)
391469

>  <LOCATION_CODE> (2,896)
PTNCS

>  <AMOUNT_CURRENT> (2,896)
32.5

$$$$
WAY-273531
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
    5.8875   -7.7875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  1  1  0  0  0  0
  8  4  1  0  0  0  0
  9  2  2  0  0  0  0
 10  3  1  0  0  0  0
 11  7  2  0  0  0  0
 12  6  1  0  0  0  0
 13  8  1  0  0  0  0
 14 11  1  0  0  0  0
 15  7  1  0  0  0  0
 16 10  1  0  0  0  0
 17 11  1  0  0  0  0
 18 14  1  0  0  0  0
 19 16  1  0  0  0  0
 20 15  2  0  0  0  0
 21 19  1  0  0  0  0
 22 20  1  0  0  0  0
  6  4  2  0  0  0  0
 22 17  2  0  0  0  0
 12 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,897)
2897

>  <Formula> (2,897)
C16H18N2O2S2

>  <MolWeight> (2,897)
334.45632

>  <PCAT_CMPD_ID> (2,897)
WAY-273531

>  <CNC_ID> (2,897)
359340800

>  <transfer_container_id> (2,897)
PTN000000068

>  <COMPOUND_NUMBER> (2,897)
WAY-273531

>  <BAR_CODE_NO> (2,897)
391476

>  <LOCATION_CODE> (2,897)
PTNCS

>  <AMOUNT_CURRENT> (2,897)
32.5

$$$$
WAY-273567
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -2.0125    1.7375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0125    2.4875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  2  0  0  0  0
  6  4  2  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  1  1  0  0  0  0
 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12  9  2  0  0  0  0
 13  9  1  0  0  0  0
 14  8  1  0  0  0  0
 15 16  1  0  0  0  0
 16 13  2  0  0  0  0
 17 12  1  0  0  0  0
 18  7  1  0  0  0  0
 19 15  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22 18  1  0  0  0  0
 23 20  1  0  0  0  0
 17 15  2  0  0  0  0
  5  6  1  0  0  0  0
 11 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,898)
2898

>  <Formula> (2,898)
C17H20N2O2S2

>  <MolWeight> (2,898)
348.4829

>  <PCAT_CMPD_ID> (2,898)
WAY-273567

>  <CNC_ID> (2,898)
359340836

>  <transfer_container_id> (2,898)
PTN000000068

>  <COMPOUND_NUMBER> (2,898)
WAY-273567

>  <BAR_CODE_NO> (2,898)
391512

>  <LOCATION_CODE> (2,898)
PTNCS

>  <AMOUNT_CURRENT> (2,898)
32.5

$$$$
WAY-273618
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  2  0  0  0  0
  6  4  2  0  0  0  0
  7  2  1  0  0  0  0
  8 13  1  0  0  0  0
  9  8  1  0  0  0  0
 10  4  1  0  0  0  0
 11  1  1  0  0  0  0
 12  3  2  0  0  0  0
 13  7  1  0  0  0  0
 14  8  2  0  0  0  0
 15  6  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  2  0  0  0  0
 18 10  1  0  0  0  0
 19 20  2  0  0  0  0
 20 17  1  0  0  0  0
 21 16  2  0  0  0  0
 22 19  1  0  0  0  0
 23  9  1  0  0  0  0
 24  9  1  0  0  0  0
 25 23  1  0  0  0  0
 26 24  1  0  0  0  0
 21 19  1  0  0  0  0
  5  6  1  0  0  0  0
 15 18  1  0  0  0  0
 26 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,899)
2899

>  <Formula> (2,899)
C18H18ClN3O2S2

>  <MolWeight> (2,899)
407.93742

>  <PCAT_CMPD_ID> (2,899)
WAY-273618

>  <CNC_ID> (2,899)
359340887

>  <transfer_container_id> (2,899)
PTN000000068

>  <COMPOUND_NUMBER> (2,899)
WAY-273618

>  <BAR_CODE_NO> (2,899)
391563

>  <LOCATION_CODE> (2,899)
PTNCS

>  <AMOUNT_CURRENT> (2,899)
32.5

$$$$
WAY-273630
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
   -2.0125    1.7375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 18  6  1  0  0  0  0
 19 11  2  0  0  0  0
 20  7  1  0  0  0  0
 21  9  2  0  0  0  0
 22  9  1  0  0  0  0
 23 14  1  0  0  0  0
 24  8  1  0  0  0  0
 25 27  1  0  0  0  0
 26 21  1  0  0  0  0
 27 22  2  0  0  0  0
 28 25  1  0  0  0  0
 26 25  2  0  0  0  0
  5  6  1  0  0  0  0
 18 24  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,900)
2900

>  <Formula> (2,900)
C19H16ClN3O3S2

>  <MolWeight> (2,900)
433.93164

>  <PCAT_CMPD_ID> (2,900)
WAY-273630

>  <CNC_ID> (2,900)
359340899

>  <transfer_container_id> (2,900)
PTN000000068

>  <COMPOUND_NUMBER> (2,900)
WAY-273630

>  <BAR_CODE_NO> (2,900)
391575

>  <LOCATION_CODE> (2,900)
PTNCS

>  <AMOUNT_CURRENT> (2,900)
32.5

$$$$
WAY-273631
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  5  2  2  0  0  0  0
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  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  1  1  0  0  0  0
 10  3  2  0  0  0  0
 11 16  1  0  0  0  0
 12 11  1  0  0  0  0
 13  6  1  0  0  0  0
 14 11  2  0  0  0  0
 15 24  1  0  0  0  0
 16  7  1  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
 19  8  1  0  0  0  0
 20 23  1  0  0  0  0
 21 12  1  0  0  0  0
 22 17  1  0  0  0  0
 23 18  2  0  0  0  0
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 25 20  1  0  0  0  0
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 27 24  1  0  0  0  0
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 22 20  2  0  0  0  0
  5  6  1  0  0  0  0
 13 19  1  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,901)
2901

>  <Formula> (2,901)
C19H20ClN3O3S2

>  <MolWeight> (2,901)
437.9634

>  <PCAT_CMPD_ID> (2,901)
WAY-273631

>  <CNC_ID> (2,901)
359340900

>  <transfer_container_id> (2,901)
PTN000000068

>  <COMPOUND_NUMBER> (2,901)
WAY-273631

>  <BAR_CODE_NO> (2,901)
391576

>  <LOCATION_CODE> (2,901)
PTNCS

>  <AMOUNT_CURRENT> (2,901)
32.5

$$$$
WAY-273657
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  5  2  2  0  0  0  0
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  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
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 10  3  2  0  0  0  0
 11 20  1  0  0  0  0
 12 23  1  0  0  0  0
 13 12  1  0  0  0  0
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 18  6  1  0  0  0  0
 19 11  2  0  0  0  0
 20  7  1  0  0  0  0
 21  9  2  0  0  0  0
 22  9  1  0  0  0  0
 23 14  1  0  0  0  0
 24  8  1  0  0  0  0
 25 27  1  0  0  0  0
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 27 22  2  0  0  0  0
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 26 25  2  0  0  0  0
  5  6  1  0  0  0  0
 18 24  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,902)
2902

>  <Formula> (2,902)
C19H16BrN3O3S2

>  <MolWeight> (2,902)
478.38264

>  <PCAT_CMPD_ID> (2,902)
WAY-273657

>  <CNC_ID> (2,902)
359340926

>  <transfer_container_id> (2,902)
PTN000000068

>  <COMPOUND_NUMBER> (2,902)
WAY-273657

>  <BAR_CODE_NO> (2,902)
391602

>  <LOCATION_CODE> (2,902)
PTNCS

>  <AMOUNT_CURRENT> (2,902)
32.5

$$$$
WAY-273658
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
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 13  6  1  0  0  0  0
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 16  7  1  0  0  0  0
 17  9  2  0  0  0  0
 18  9  1  0  0  0  0
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 20 23  1  0  0  0  0
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 22 20  2  0  0  0  0
  5  6  1  0  0  0  0
 13 19  1  0  0  0  0
 28 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,903)
2903

>  <Formula> (2,903)
C19H20BrN3O3S2

>  <MolWeight> (2,903)
482.4144

>  <PCAT_CMPD_ID> (2,903)
WAY-273658

>  <CNC_ID> (2,903)
359340927

>  <transfer_container_id> (2,903)
PTN000000068

>  <COMPOUND_NUMBER> (2,903)
WAY-273658

>  <BAR_CODE_NO> (2,903)
391603

>  <LOCATION_CODE> (2,903)
PTNCS

>  <AMOUNT_CURRENT> (2,903)
32.5

$$$$
WAY-273668
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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 16  3  2  0  0  0  0
 17 10  2  0  0  0  0
 18  6  1  0  0  0  0
 19  9  1  0  0  0  0
 20 13  1  0  0  0  0
 21 13  2  0  0  0  0
 22 11  1  0  0  0  0
 23 26  2  0  0  0  0
 24 10  1  0  0  0  0
 25 20  2  0  0  0  0
 26 21  1  0  0  0  0
 27 23  1  0  0  0  0
 28 24  1  0  0  0  0
 25 23  1  0  0  0  0
  5  6  1  0  0  0  0
 18 22  1  0  0  0  0
 12  7  2  0  0  0  0
M  END
>  <Mol_ID> (2,904)
2904

>  <Formula> (2,904)
C19H15BrN2O4S2

>  <MolWeight> (2,904)
479.3674

>  <PCAT_CMPD_ID> (2,904)
WAY-273668

>  <CNC_ID> (2,904)
359340937

>  <transfer_container_id> (2,904)
PTN000000068

>  <COMPOUND_NUMBER> (2,904)
WAY-273668

>  <BAR_CODE_NO> (2,904)
391613

>  <LOCATION_CODE> (2,904)
PTNCS

>  <AMOUNT_CURRENT> (2,904)
32.5

$$$$
WAY-273698
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.0125    1.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9833    3.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  4  1  0  0  0  0
  4  6  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  1  0  0  0  0
 10  3  1  0  0  0  0
 11  6  2  0  0  0  0
 12  4  1  0  0  0  0
 13  8  1  0  0  0  0
 14 10  1  0  0  0  0
 15  9  1  0  0  0  0
 16 14  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
 19 15  2  0  0  0  0
 20 16  1  0  0  0  0
  8  9  2  0  0  0  0
  3  5  2  0  0  0  0
 19 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,905)
2905

>  <Formula> (2,905)
C15H17N3OS

>  <MolWeight> (2,905)
287.37998

>  <PCAT_CMPD_ID> (2,905)
WAY-273698

>  <CNC_ID> (2,905)
359340967

>  <transfer_container_id> (2,905)
PTN000000068

>  <COMPOUND_NUMBER> (2,905)
WAY-273698

>  <BAR_CODE_NO> (2,905)
391643

>  <LOCATION_CODE> (2,905)
PTNCS

>  <AMOUNT_CURRENT> (2,905)
32.5

$$$$
WAY-273710
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -2.0125    1.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500    1.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11  4  2  0  0  0  0
 12 14  1  0  0  0  0
 13 12  2  0  0  0  0
 14 10  1  0  0  0  0
 15  3  1  0  0  0  0
 16 12  1  0  0  0  0
 17  8  1  0  0  0  0
 18  9  1  0  0  0  0
 19 16  1  0  0  0  0
 20 17  2  0  0  0  0
 21 18  2  0  0  0  0
 22 19  1  0  0  0  0
  8  9  2  0  0  0  0
  6  5  2  0  0  0  0
 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,906)
2906

>  <Formula> (2,906)
C15H15N3O3S

>  <MolWeight> (2,906)
317.3629

>  <PCAT_CMPD_ID> (2,906)
WAY-273710

>  <CNC_ID> (2,906)
359340979

>  <transfer_container_id> (2,906)
PTN000000068

>  <COMPOUND_NUMBER> (2,906)
WAY-273710

>  <BAR_CODE_NO> (2,906)
391655

>  <LOCATION_CODE> (2,906)
PTNCS

>  <AMOUNT_CURRENT> (2,906)
32.5

$$$$
WAY-273813
csChFnd80/10111816222D

 34 38  0  0  0  0  0  0  0  0999 V2000
   -2.0125    1.1833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  2  0  0  0  0
 11  7  1  0  0  0  0
 12  9  1  0  0  0  0
 13  5  1  0  0  0  0
 14 18  1  0  0  0  0
 15 10  1  0  0  0  0
 16  2  1  0  0  0  0
 17 12  2  0  0  0  0
 18 21  1  0  0  0  0
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 25 23  1  0  0  0  0
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 27  8  1  0  0  0  0
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 29 24  1  0  0  0  0
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 33 28  2  0  0  0  0
 34 31  1  0  0  0  0
  8 11  2  0  0  0  0
  5  6  2  0  0  0  0
 33 32  1  0  0  0  0
 26 24  1  0  0  0  0
 15 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,907)
2907

>  <Formula> (2,907)
C24H21N5O4S

>  <MolWeight> (2,907)
475.51964

>  <PCAT_CMPD_ID> (2,907)
WAY-273813

>  <CNC_ID> (2,907)
359341082

>  <transfer_container_id> (2,907)
PTN000000068

>  <COMPOUND_NUMBER> (2,907)
WAY-273813

>  <BAR_CODE_NO> (2,907)
391758

>  <LOCATION_CODE> (2,907)
PTNCS

>  <AMOUNT_CURRENT> (2,907)
32.5

$$$$
WAY-273881
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
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 10 14  1  0  0  0  0
 11  7  2  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14 13  2  0  0  0  0
 15 12  1  0  0  0  0
 16  2  1  0  0  0  0
 17 10  1  0  0  0  0
 18  7  1  0  0  0  0
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 21 17  1  0  0  0  0
  4  5  1  0  0  0  0
 16 19  1  0  0  0  0
 10 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,908)
2908

>  <Formula> (2,908)
C17H20N2OS

>  <MolWeight> (2,908)
300.4185

>  <PCAT_CMPD_ID> (2,908)
WAY-273881

>  <CNC_ID> (2,908)
359341150

>  <transfer_container_id> (2,908)
PTN000000068

>  <COMPOUND_NUMBER> (2,908)
WAY-273881

>  <BAR_CODE_NO> (2,908)
391826

>  <LOCATION_CODE> (2,908)
PTNCS

>  <AMOUNT_CURRENT> (2,908)
32.5

$$$$
WAY-273887
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  2  0  0  0  0
 10  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  8  2  0  0  0  0
 13  2  1  0  0  0  0
 14 11  2  0  0  0  0
 15 12  1  0  0  0  0
 16 15  2  0  0  0  0
 17  7  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20 19  1  0  0  0  0
  4  5  1  0  0  0  0
 13 18  1  0  0  0  0
 16 14  1  0  0  0  0
M  END
>  <Mol_ID> (2,909)
2909

>  <Formula> (2,909)
C16H18N2OS

>  <MolWeight> (2,909)
286.39192

>  <PCAT_CMPD_ID> (2,909)
WAY-273887

>  <CNC_ID> (2,909)
359341156

>  <transfer_container_id> (2,909)
PTN000000068

>  <COMPOUND_NUMBER> (2,909)
WAY-273887

>  <BAR_CODE_NO> (2,909)
391832

>  <LOCATION_CODE> (2,909)
PTNCS

>  <AMOUNT_CURRENT> (2,909)
32.5

$$$$
WAY-273972
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -2.0125    2.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500    3.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6125    1.9958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    2.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9958    3.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0375    2.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7458    2.7333    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1292    1.7833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5042    3.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6000    1.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2458    0.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2333    0.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6042    4.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  1  1  0  0  0  0
  9  6  2  0  0  0  0
 10  6  1  0  0  0  0
 11  3  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
 16  8  1  0  0  0  0
 17 10  2  0  0  0  0
 18 10  1  0  0  0  0
 19 14  2  0  0  0  0
 20 15  2  0  0  0  0
 21 18  2  0  0  0  0
 22 17  1  0  0  0  0
 23 21  1  0  0  0  0
  4  5  2  0  0  0  0
 20 19  1  0  0  0  0
 22 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,910)
2910

>  <Formula> (2,910)
C19H19N3O

>  <MolWeight> (2,910)
305.37366

>  <PCAT_CMPD_ID> (2,910)
WAY-273972

>  <CNC_ID> (2,910)
359341236

>  <transfer_container_id> (2,910)
PTN000000068

>  <COMPOUND_NUMBER> (2,910)
WAY-273972

>  <BAR_CODE_NO> (2,910)
391917

>  <LOCATION_CODE> (2,910)
PTNCS

>  <AMOUNT_CURRENT> (2,910)
32.5

$$$$
WAY-274003
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.6125    1.9958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500    3.1500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0125    2.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    2.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9958    3.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2250    2.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6000    1.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7667    3.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5125    3.0333    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4792    3.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6000    4.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8542    4.3417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2958    2.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0250    3.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4000    4.8542    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4583    2.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2333    3.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  2  0  0  0  0
  6 10  1  0  0  0  0
  7  1  1  0  0  0  0
  8  6  1  0  0  0  0
  9  6  2  0  0  0  0
 10 21  1  0  0  0  0
 11  8  2  0  0  0  0
 12  8  1  0  0  0  0
 13 15  1  0  0  0  0
 14  3  1  0  0  0  0
 15 12  2  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
 18  4  1  0  0  0  0
 19  5  1  0  0  0  0
 20  7  1  0  0  0  0
 21 22  1  0  0  0  0
 22 14  1  0  0  0  0
 23 20  1  0  0  0  0
 24 20  1  0  0  0  0
 25 18  2  0  0  0  0
 26 25  1  0  0  0  0
  2  5  1  0  0  0  0
 19 26  2  0  0  0  0
 16 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,911)
2911

>  <Formula> (2,911)
C21H24FN3O

>  <MolWeight> (2,911)
353.4331632

>  <PCAT_CMPD_ID> (2,911)
WAY-274003

>  <CNC_ID> (2,911)
359341267

>  <transfer_container_id> (2,911)
PTN000000068

>  <COMPOUND_NUMBER> (2,911)
WAY-274003

>  <BAR_CODE_NO> (2,911)
391948

>  <LOCATION_CODE> (2,911)
PTNCS

>  <AMOUNT_CURRENT> (2,911)
32.5

$$$$
WAY-274010
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  3  2  0  0  0  0
  8  3  2  0  0  0  0
  9  3  1  0  0  0  0
 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  2  0  0  0  0
 14 10  2  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17 16  1  0  0  0  0
 18 14  1  0  0  0  0
 19 13  1  0  0  0  0
 20 12  2  0  0  0  0
 21 15  2  0  0  0  0
 22 21  1  0  0  0  0
 23 19  2  0  0  0  0
  6  5  1  0  0  0  0
 20 23  1  0  0  0  0
 22 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,912)
2912

>  <Formula> (2,912)
C17H15NO3S2

>  <MolWeight> (2,912)
345.4359

>  <PCAT_CMPD_ID> (2,912)
WAY-274010

>  <CNC_ID> (2,912)
359341274

>  <transfer_container_id> (2,912)
PTN000000068

>  <COMPOUND_NUMBER> (2,912)
WAY-274010

>  <BAR_CODE_NO> (2,912)
391955

>  <LOCATION_CODE> (2,912)
PTNCS

>  <AMOUNT_CURRENT> (2,912)
32.5

$$$$
WAY-274011
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -0.5999    0.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0999   -1.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  3  9  2  0  0  0  0
  4 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 15 21  2  0  0  0  0
 16 22  1  0  0  0  0
 18 23  1  0  0  0  0
 19 24  2  0  0  0  0
 22 25  1  0  0  0  0
 23 26  2  0  0  0  0
  5 10  1  0  0  0  0
 17 22  2  0  0  0  0
 24 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,913)
2913

>  <Formula> (2,913)
C18H16N2O4S2

>  <MolWeight> (2,913)
388.46064

>  <PCAT_CMPD_ID> (2,913)
WAY-274011

>  <CNC_ID> (2,913)
359341275

>  <transfer_container_id> (2,913)
PTN000000068

>  <COMPOUND_NUMBER> (2,913)
WAY-274011

>  <BAR_CODE_NO> (2,913)
391956

>  <LOCATION_CODE> (2,913)
PTNCS

>  <AMOUNT_CURRENT> (2,913)
32.5

$$$$
WAY-274012
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
    0.0248   -0.2103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3179   -1.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0856   -0.1448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8407   -2.9414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0075    3.7414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6821   -2.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  3  9  2  0  0  0  0
  4 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  2  0  0  0  0
 19 22  1  0  0  0  0
 20 23  2  0  0  0  0
  5 10  1  0  0  0  0
 16 19  2  0  0  0  0
 21 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,914)
2914

>  <Formula> (2,914)
C17H15NO3S2

>  <MolWeight> (2,914)
345.4359

>  <PCAT_CMPD_ID> (2,914)
WAY-274012

>  <CNC_ID> (2,914)
359341276

>  <transfer_container_id> (2,914)
PTN000000068

>  <COMPOUND_NUMBER> (2,914)
WAY-274012

>  <BAR_CODE_NO> (2,914)
391957

>  <LOCATION_CODE> (2,914)
PTNCS

>  <AMOUNT_CURRENT> (2,914)
32.5

$$$$
WAY-274014
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5375    2.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7583    0.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9833    1.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5458    0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1500    0.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  3  2  0  0  0  0
 10  3  2  0  0  0  0
 11 16  1  0  0  0  0
 12  5  1  0  0  0  0
 13 11  2  0  0  0  0
 14  7  1  0  0  0  0
 15  7  2  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18 20  2  0  0  0  0
 19 14  2  0  0  0  0
 20 15  1  0  0  0  0
 21 18  1  0  0  0  0
 22 12  2  0  0  0  0
 23 12  1  0  0  0  0
 24 22  1  0  0  0  0
 25 23  2  0  0  0  0
 26 25  1  0  0  0  0
  6  5  1  0  0  0  0
 19 18  1  0  0  0  0
 26 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,915)
2915

>  <Formula> (2,915)
C17H13ClN2O4S2

>  <MolWeight> (2,915)
408.87912

>  <PCAT_CMPD_ID> (2,915)
WAY-274014

>  <CNC_ID> (2,915)
359341278

>  <transfer_container_id> (2,915)
PTN000000068

>  <COMPOUND_NUMBER> (2,915)
WAY-274014

>  <BAR_CODE_NO> (2,915)
391959

>  <LOCATION_CODE> (2,915)
PTNCS

>  <AMOUNT_CURRENT> (2,915)
32.5

$$$$
WAY-274020
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5375    2.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9250    3.5250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5833    1.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.1958    1.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.1292    0.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9708    1.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5375    0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9292    0.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    4.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9208    3.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958    5.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4458    4.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7833    5.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  4  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  2  0  0  0  0
 10  5  1  0  0  0  0
 11  3  1  0  0  0  0
 12 14  1  0  0  0  0
 13 12  2  0  0  0  0
 14  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16 10  2  0  0  0  0
 17 12  1  0  0  0  0
 18 19  2  0  0  0  0
 19 16  1  0  0  0  0
 20 15  2  0  0  0  0
 21 18  1  0  0  0  0
 22 11  1  0  0  0  0
 23 11  2  0  0  0  0
 24 22  2  0  0  0  0
 25 23  1  0  0  0  0
 26 25  2  0  0  0  0
  6  5  1  0  0  0  0
 24 26  1  0  0  0  0
 20 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,916)
2916

>  <Formula> (2,916)
C17H13FN2O4S2

>  <MolWeight> (2,916)
392.4245232

>  <PCAT_CMPD_ID> (2,916)
WAY-274020

>  <CNC_ID> (2,916)
359341284

>  <transfer_container_id> (2,916)
PTN000000068

>  <COMPOUND_NUMBER> (2,916)
WAY-274020

>  <BAR_CODE_NO> (2,916)
391965

>  <LOCATION_CODE> (2,916)
PTNCS

>  <AMOUNT_CURRENT> (2,916)
32.5

$$$$
WAY-274023
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4458    4.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5375    0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9292    0.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2958    5.7500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  3  2  0  0  0  0
 10  3  2  0  0  0  0
 11  5  1  0  0  0  0
 12 16  1  0  0  0  0
 13 12  2  0  0  0  0
 14  7  1  0  0  0  0
 15  7  2  0  0  0  0
 16  8  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  2  0  0  0  0
 19 12  1  0  0  0  0
 20 24  2  0  0  0  0
 21 23  2  0  0  0  0
 22 14  2  0  0  0  0
 23 18  1  0  0  0  0
 24 15  1  0  0  0  0
 25 17  2  0  0  0  0
 26 21  1  0  0  0  0
 27 20  1  0  0  0  0
  6  5  1  0  0  0  0
 22 20  1  0  0  0  0
 21 25  1  0  0  0  0
M  END
>  <Mol_ID> (2,917)
2917

>  <Formula> (2,917)
C17H12F2N2O4S2

>  <MolWeight> (2,917)
410.4149864

>  <PCAT_CMPD_ID> (2,917)
WAY-274023

>  <CNC_ID> (2,917)
359341287

>  <transfer_container_id> (2,917)
PTN000000068

>  <COMPOUND_NUMBER> (2,917)
WAY-274023

>  <BAR_CODE_NO> (2,917)
391968

>  <LOCATION_CODE> (2,917)
PTNCS

>  <AMOUNT_CURRENT> (2,917)
32.5

$$$$
WAY-274024
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4458    4.3250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2958    5.7500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5083    0.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  3  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  2  0  0  0  0
 10  5  1  0  0  0  0
 11  4  1  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14 10  2  0  0  0  0
 15 10  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  1  0  0  0  0
 18 12  2  0  0  0  0
 19 14  1  0  0  0  0
 20 13  1  0  0  0  0
 21 15  2  0  0  0  0
 22 17  1  0  0  0  0
 23 16  1  0  0  0  0
 24 11  1  0  0  0  0
  6  5  1  0  0  0  0
 18 16  1  0  0  0  0
 17 19  2  0  0  0  0
M  END
>  <Mol_ID> (2,918)
2918

>  <Formula> (2,918)
C16H11F2NO3S2

>  <MolWeight> (2,918)
367.3902464

>  <PCAT_CMPD_ID> (2,918)
WAY-274024

>  <CNC_ID> (2,918)
359341288

>  <transfer_container_id> (2,918)
PTN000000068

>  <COMPOUND_NUMBER> (2,918)
WAY-274024

>  <BAR_CODE_NO> (2,918)
391969

>  <LOCATION_CODE> (2,918)
PTNCS

>  <AMOUNT_CURRENT> (2,918)
32.5

$$$$
WAY-274027
csChFnd80/10111816222D

 21 23  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5833    1.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9250    3.5250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5375    2.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8458    0.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2583    1.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6583    0.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9208    1.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    4.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9208    3.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5083    0.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4458    4.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958    5.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7833    5.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  5  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  2  0  0  0  0
 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
 15 12  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18 13  1  0  0  0  0
 19 17  1  0  0  0  0
 20 16  2  0  0  0  0
 21 19  2  0  0  0  0
  6  5  1  0  0  0  0
 20 21  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,919)
2919

>  <Formula> (2,919)
C14H11NO4S2

>  <MolWeight> (2,919)
321.37144

>  <PCAT_CMPD_ID> (2,919)
WAY-274027

>  <CNC_ID> (2,919)
359341291

>  <transfer_container_id> (2,919)
PTN000000068

>  <COMPOUND_NUMBER> (2,919)
WAY-274027

>  <BAR_CODE_NO> (2,919)
391972

>  <LOCATION_CODE> (2,919)
PTNCS

>  <AMOUNT_CURRENT> (2,919)
32.5

$$$$
WAY-274028
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5833    1.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9250    3.5250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5375    2.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8458    0.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2583    1.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6583    0.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9208    1.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    4.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5958    5.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4458    4.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7833    5.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  5  1  0  0  0  0
  8  3  2  0  0  0  0
  9  3  2  0  0  0  0
 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
 15 12  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18 13  1  0  0  0  0
 19 18  1  0  0  0  0
 20 16  2  0  0  0  0
 21 17  1  0  0  0  0
 22 21  2  0  0  0  0
  6  5  1  0  0  0  0
 20 22  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,920)
2920

>  <Formula> (2,920)
C15H13NO4S2

>  <MolWeight> (2,920)
335.39802

>  <PCAT_CMPD_ID> (2,920)
WAY-274028

>  <CNC_ID> (2,920)
359341292

>  <transfer_container_id> (2,920)
PTN000000068

>  <COMPOUND_NUMBER> (2,920)
WAY-274028

>  <BAR_CODE_NO> (2,920)
391973

>  <LOCATION_CODE> (2,920)
PTNCS

>  <AMOUNT_CURRENT> (2,920)
32.5

$$$$
WAY-274033
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
   -2.7125    2.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    2.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2333    3.0833    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250    1.1458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5833    1.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5375    2.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9250    3.5250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8458    0.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2583    1.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6583    0.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9208    1.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    4.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7833    5.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.5083    0.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1208    0.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  2  0  0  0  0
  6  4  1  0  0  0  0
  7  5  1  0  0  0  0
  8  3  1  0  0  0  0
  9  3  2  0  0  0  0
 10  3  2  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  4  1  0  0  0  0
 14 11  1  0  0  0  0
 15 12  1  0  0  0  0
 16  8  1  0  0  0  0
 17  8  2  0  0  0  0
 18 20  2  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 22 13  1  0  0  0  0
 23 22  1  0  0  0  0
  6  5  1  0  0  0  0
 19 18  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <Mol_ID> (2,921)
2921

>  <Formula> (2,921)
C15H12FNO4S2

>  <MolWeight> (2,921)
353.3884832

>  <PCAT_CMPD_ID> (2,921)
WAY-274033

>  <CNC_ID> (2,921)
359341297

>  <transfer_container_id> (2,921)
PTN000000068

>  <COMPOUND_NUMBER> (2,921)
WAY-274033

>  <BAR_CODE_NO> (2,921)
391978

>  <LOCATION_CODE> (2,921)
PTNCS

>  <AMOUNT_CURRENT> (2,921)
32.5

$$$$
WAY-274060
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
    6.6375   -8.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3667   -7.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9667   -9.2167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8542   -7.2417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6917   -7.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0875   -6.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5417   -7.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2875   -8.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3250   -5.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9167   -8.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2042  -11.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  6  2  0  0  0  0
 11  6  1  0  0  0  0
 12  5  2  0  0  0  0
 13  9  2  0  0  0  0
 14 10  1  0  0  0  0
 15 11  2  0  0  0  0
 16  9  1  0  0  0  0
 17 15  1  0  0  0  0
 18 15  1  0  0  0  0
 19  7  1  0  0  0  0
 20 10  1  0  0  0  0
 21  8  1  0  0  0  0
 22 16  1  0  0  0  0
 23 20  1  0  0  0  0
 24 19  2  0  0  0  0
 25 21  2  0  0  0  0
 26 22  1  0  0  0  0
  7  8  2  0  0  0  0
 25 24  1  0  0  0  0
 17 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,922)
2922

>  <Formula> (2,922)
C19H17ClN2O4

>  <MolWeight> (2,922)
372.80228

>  <PCAT_CMPD_ID> (2,922)
WAY-274060

>  <CNC_ID> (2,922)
359341324

>  <transfer_container_id> (2,922)
PTN000000068

>  <COMPOUND_NUMBER> (2,922)
WAY-274060

>  <BAR_CODE_NO> (2,922)
392005

>  <LOCATION_CODE> (2,922)
PTNCS

>  <AMOUNT_CURRENT> (2,922)
32.5

$$$$
WAY-274151
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -2.2500    2.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8125    2.9583    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3750    3.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6250    3.5083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1958    2.5208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.2333    2.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4583    2.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  4  2  0  0  0  0
  8  6  1  0  0  0  0
  9  2  2  0  0  0  0
 10  2  2  0  0  0  0
 11  8  1  0  0  0  0
 12  8  2  0  0  0  0
 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15  5  1  0  0  0  0
 16  4  1  0  0  0  0
 17 14  2  0  0  0  0
 18  7  1  0  0  0  0
 19 20  1  0  0  0  0
 20 13  2  0  0  0  0
 21 19  2  0  0  0  0
 22 17  1  0  0  0  0
 23 16  2  0  0  0  0
 24 23  1  0  0  0  0
  5  7  1  0  0  0  0
 18 24  2  0  0  0  0
 21 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,923)
2923

>  <Formula> (2,923)
C18H18N2O3S

>  <MolWeight> (2,923)
342.41212

>  <PCAT_CMPD_ID> (2,923)
WAY-274151

>  <CNC_ID> (2,923)
359341414

>  <transfer_container_id> (2,923)
PTN000000068

>  <COMPOUND_NUMBER> (2,923)
WAY-274151

>  <BAR_CODE_NO> (2,923)
392096

>  <LOCATION_CODE> (2,923)
PTNCS

>  <AMOUNT_CURRENT> (2,923)
32.5

$$$$
WAY-274188
csChFnd80/10111816222D

 29 32  0  0  0  0  0  0  0  0999 V2000
   -2.2500    2.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8125    2.9583    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6125    1.1875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0125    1.6333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  2  0  0  0  0
 11  2  2  0  0  0  0
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 22  9  1  0  0  0  0
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 15 20  1  0  0  0  0
 29 27  1  0  0  0  0
M  END
>  <Mol_ID> (2,924)
2924

>  <Formula> (2,924)
C22H23FN2O3S

>  <MolWeight> (2,924)
414.4930232

>  <PCAT_CMPD_ID> (2,924)
WAY-274188

>  <CNC_ID> (2,924)
359341451

>  <transfer_container_id> (2,924)
PTN000000068

>  <COMPOUND_NUMBER> (2,924)
WAY-274188

>  <BAR_CODE_NO> (2,924)
392133

>  <LOCATION_CODE> (2,924)
PTNCS

>  <AMOUNT_CURRENT> (2,924)
32.5

$$$$
WAY-277104
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
   -3.0418    1.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6 10  1  0  0  0  0
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 11 12  1  0  0  0  0
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 13 15  1  0  0  0  0
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 17 18  1  0  0  0  0
  6  7  2  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,925)
2925

>  <Formula> (2,925)
C12H13N3O2S

>  <MolWeight> (2,925)
263.31552

>  <PCAT_CMPD_ID> (2,925)
WAY-277104

>  <CNC_ID> (2,925)
359341651

>  <transfer_container_id> (2,925)
PTN000000068

>  <COMPOUND_NUMBER> (2,925)
WAY-277104

>  <BAR_CODE_NO> (2,925)
389803

>  <LOCATION_CODE> (2,925)
PTNCS

>  <AMOUNT_CURRENT> (2,925)
32.5

$$$$
WAY-277171
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  2  0  0  0  0
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  6  7  1  0  0  0  0
  7  9  1  0  0  0  0
  8  1  1  0  0  0  0
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 10  2  2  0  0  0  0
 11  3  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  2  0  0  0  0
 14  8  1  0  0  0  0
 15  8  2  0  0  0  0
 16 19  2  0  0  0  0
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 21  6  1  0  0  0  0
 22 12  1  0  0  0  0
 23 21  2  0  0  0  0
 24 23  1  0  0  0  0
  4  5  1  0  0  0  0
 18 16  1  0  0  0  0
 22 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,926)
2926

>  <Formula> (2,926)
C16H12F2N4OS

>  <MolWeight> (2,926)
346.3544864

>  <PCAT_CMPD_ID> (2,926)
WAY-277171

>  <CNC_ID> (2,926)
359341718

>  <transfer_container_id> (2,926)
PTN000000068

>  <COMPOUND_NUMBER> (2,926)
WAY-277171

>  <BAR_CODE_NO> (2,926)
389871

>  <LOCATION_CODE> (2,926)
PTNCS

>  <AMOUNT_CURRENT> (2,926)
32.5

$$$$
WAY-277222
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  7  2  0  0  0  0
 11  6  2  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14  8  1  0  0  0  0
 15  8  2  0  0  0  0
 16 18  2  0  0  0  0
 17 14  2  0  0  0  0
 18 15  1  0  0  0  0
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 20  6  1  0  0  0  0
  4  5  1  0  0  0  0
 13 12  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Mol_ID> (2,927)
2927

>  <Formula> (2,927)
C15H13BrN2O2

>  <MolWeight> (2,927)
333.17992

>  <PCAT_CMPD_ID> (2,927)
WAY-277222

>  <CNC_ID> (2,927)
359341767

>  <transfer_container_id> (2,927)
PTN000000068

>  <COMPOUND_NUMBER> (2,927)
WAY-277222

>  <BAR_CODE_NO> (2,927)
389922

>  <LOCATION_CODE> (2,927)
PTNCS

>  <AMOUNT_CURRENT> (2,927)
32.5

$$$$
WAY-277235
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
   -1.8958    2.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  4  1  0  0  0  0
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 15  6  1  0  0  0  0
 16  5  1  0  0  0  0
 17 14  1  0  0  0  0
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 25 24  2  0  0  0  0
  2  7  1  0  0  0  0
 11  8  1  0  0  0  0
 23 25  1  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,928)
2928

>  <Formula> (2,928)
C18H16N6O

>  <MolWeight> (2,928)
332.35924

>  <PCAT_CMPD_ID> (2,928)
WAY-277235

>  <CNC_ID> (2,928)
359341780

>  <transfer_container_id> (2,928)
PTN000000068

>  <COMPOUND_NUMBER> (2,928)
WAY-277235

>  <BAR_CODE_NO> (2,928)
389935

>  <LOCATION_CODE> (2,928)
PTNCS

>  <AMOUNT_CURRENT> (2,928)
32.5

$$$$
WAY-277237
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  9  2  0  0  0  0
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 13 10  1  0  0  0  0
 14  4  2  0  0  0  0
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 19  6  1  0  0  0  0
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 18 21  1  0  0  0  0
 11  8  1  0  0  0  0
 23 25  2  0  0  0  0
M  END
>  <Mol_ID> (2,929)
2929

>  <Formula> (2,929)
C18H15BrN6O

>  <MolWeight> (2,929)
411.2553

>  <PCAT_CMPD_ID> (2,929)
WAY-277237

>  <CNC_ID> (2,929)
359341782

>  <transfer_container_id> (2,929)
PTN000000068

>  <COMPOUND_NUMBER> (2,929)
WAY-277237

>  <BAR_CODE_NO> (2,929)
389937

>  <LOCATION_CODE> (2,929)
PTNCS

>  <AMOUNT_CURRENT> (2,929)
32.5

$$$$
WAY-277253
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  7  1  1  0  0  0  0
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 10  6  2  0  0  0  0
 11  2  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  7  2  0  0  0  0
 15 17  2  0  0  0  0
 16 13  2  0  0  0  0
 17 14  1  0  0  0  0
 18 15  1  0  0  0  0
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 20 12  1  0  0  0  0
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 22 20  2  0  0  0  0
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 24 22  1  0  0  0  0
  5  4  1  0  0  0  0
 16 15  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,930)
2930

>  <Formula> (2,930)
C17H15FN4OS

>  <MolWeight> (2,930)
342.3906032

>  <PCAT_CMPD_ID> (2,930)
WAY-277253

>  <CNC_ID> (2,930)
359341798

>  <transfer_container_id> (2,930)
PTN000000068

>  <COMPOUND_NUMBER> (2,930)
WAY-277253

>  <BAR_CODE_NO> (2,930)
389953

>  <LOCATION_CODE> (2,930)
PTNCS

>  <AMOUNT_CURRENT> (2,930)
29.4

$$$$
WAY-277282
csChFnd80/10111816222D

 16 17  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  1  0  0  0  0
 13  9  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 16 15  1  0  0  0  0
  6  5  2  0  0  0  0
 14 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,931)
2931

>  <Formula> (2,931)
C10H15N3OS2

>  <MolWeight> (2,931)
257.3756

>  <PCAT_CMPD_ID> (2,931)
WAY-277282

>  <CNC_ID> (2,931)
359341827

>  <transfer_container_id> (2,931)
PTN000000068

>  <COMPOUND_NUMBER> (2,931)
WAY-277282

>  <BAR_CODE_NO> (2,931)
389982

>  <LOCATION_CODE> (2,931)
PTNCS

>  <AMOUNT_CURRENT> (2,931)
32.5

$$$$
WAY-277306
csChFnd80/10111816222D

 24 28  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
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  5  6  1  0  0  0  0
 10 12  1  0  0  0  0
 15 14  1  0  0  0  0
 22 24  2  0  0  0  0
 17 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,932)
2932

>  <Formula> (2,932)
C19H15N5

>  <MolWeight> (2,932)
313.3559

>  <PCAT_CMPD_ID> (2,932)
WAY-277306

>  <CNC_ID> (2,932)
359341851

>  <transfer_container_id> (2,932)
PTN000000068

>  <COMPOUND_NUMBER> (2,932)
WAY-277306

>  <BAR_CODE_NO> (2,932)
390006

>  <LOCATION_CODE> (2,932)
PTNCS

>  <AMOUNT_CURRENT> (2,932)
32.5

$$$$
WAY-277349
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
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 10  8  1  0  0  0  0
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 13  9  1  0  0  0  0
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 29 28  2  0  0  0  0
  4  5  1  0  0  0  0
 11 17  1  0  0  0  0
 27 29  1  0  0  0  0
  9 12  2  0  0  0  0
 16 15  1  0  0  0  0
M  END
>  <Mol_ID> (2,933)
2933

>  <Formula> (2,933)
C22H19N3O3S

>  <MolWeight> (2,933)
405.46956

>  <PCAT_CMPD_ID> (2,933)
WAY-277349

>  <CNC_ID> (2,933)
359341894

>  <transfer_container_id> (2,933)
PTN000000068

>  <COMPOUND_NUMBER> (2,933)
WAY-277349

>  <BAR_CODE_NO> (2,933)
390049

>  <LOCATION_CODE> (2,933)
PTNCS

>  <AMOUNT_CURRENT> (2,933)
32.5

$$$$
WAY-277368
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
    8.0985   10.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  6  2  0  0  0  0
 11  4  1  0  0  0  0
 12  9  2  0  0  0  0
 13  9  1  0  0  0  0
 14  7  1  0  0  0  0
 15 16  1  0  0  0  0
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 18 15  1  0  0  0  0
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  5  4  2  0  0  0  0
  7  8  2  0  0  0  0
 17 15  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (2,934)
2934

>  <Formula> (2,934)
C22H22N4O2

>  <MolWeight> (2,934)
374.43568

>  <PCAT_CMPD_ID> (2,934)
WAY-277368

>  <CNC_ID> (2,934)
359341913

>  <transfer_container_id> (2,934)
PTN000000068

>  <COMPOUND_NUMBER> (2,934)
WAY-277368

>  <BAR_CODE_NO> (2,934)
390068

>  <LOCATION_CODE> (2,934)
PTNCS

>  <AMOUNT_CURRENT> (2,934)
32.5

$$$$
WAY-277545
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
    9.0669    8.3305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12  3  1  0  0  0  0
 13 22  1  0  0  0  0
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 15  5  1  0  0  0  0
 16  2  2  0  0  0  0
 17  2  2  0  0  0  0
 18 10  1  0  0  0  0
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 20 10  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 18  2  0  0  0  0
 24 18  1  0  0  0  0
 25  9  1  0  0  0  0
 26 29  1  0  0  0  0
 27  8  1  0  0  0  0
 28  8  1  0  0  0  0
 29 28  1  0  0  0  0
 30 27  1  0  0  0  0
 31 25  1  0  0  0  0
 32 25  1  0  0  0  0
  4  5  2  0  0  0  0
 19  9  1  0  0  0  0
 21 13  2  0  0  0  0
 30 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,935)
2935

>  <Formula> (2,935)
C22H26N4O4S2

>  <MolWeight> (2,935)
474.59624

>  <PCAT_CMPD_ID> (2,935)
WAY-277545

>  <CNC_ID> (2,935)
359342090

>  <transfer_container_id> (2,935)
PTN000000068

>  <COMPOUND_NUMBER> (2,935)
WAY-277545

>  <BAR_CODE_NO> (2,935)
390245

>  <LOCATION_CODE> (2,935)
PTNCS

>  <AMOUNT_CURRENT> (2,935)
29.1

$$$$
WAY-277567
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -3.1750    2.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4333    1.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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 10  2  1  0  0  0  0
 11  9  1  0  0  0  0
 12  3  1  0  0  0  0
 13  6  2  0  0  0  0
 14  6  2  0  0  0  0
 15 11  2  0  0  0  0
 16 15  1  0  0  0  0
 17  9  2  0  0  0  0
 18 20  1  0  0  0  0
 19 11  1  0  0  0  0
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 23 12  1  0  0  0  0
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 25 18  1  0  0  0  0
  4  5  2  0  0  0  0
  6  8  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,936)
2936

>  <Formula> (2,936)
C18H23N3O3S

>  <MolWeight> (2,936)
361.45852

>  <PCAT_CMPD_ID> (2,936)
WAY-277567

>  <CNC_ID> (2,936)
359342112

>  <transfer_container_id> (2,936)
PTN000000068

>  <COMPOUND_NUMBER> (2,936)
WAY-277567

>  <BAR_CODE_NO> (2,936)
390267

>  <LOCATION_CODE> (2,936)
PTNCS

>  <AMOUNT_CURRENT> (2,936)
32.5

$$$$
WAY-277686
csChFnd80/10111816222D

 29 33  0  0  0  0  0  0  0  0999 V2000
   -3.1750    2.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
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 10  2  1  0  0  0  0
 11  9  1  0  0  0  0
 12  3  1  0  0  0  0
 13 16  2  0  0  0  0
 14  6  2  0  0  0  0
 15  6  2  0  0  0  0
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 21  9  2  0  0  0  0
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 28 24  2  0  0  0  0
 29 26  1  0  0  0  0
  4  5  2  0  0  0  0
  6  8  1  0  0  0  0
 26 28  1  0  0  0  0
 17 13  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,937)
2937

>  <Formula> (2,937)
C19H14ClN3O5S

>  <MolWeight> (2,937)
431.84956

>  <PCAT_CMPD_ID> (2,937)
WAY-277686

>  <CNC_ID> (2,937)
359342231

>  <transfer_container_id> (2,937)
PTN000000068

>  <COMPOUND_NUMBER> (2,937)
WAY-277686

>  <BAR_CODE_NO> (2,937)
390386

>  <LOCATION_CODE> (2,937)
PTNCS

>  <AMOUNT_CURRENT> (2,937)
32.5

$$$$
WAY-277701
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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    0.0167    2.3958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8250    3.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5500    2.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5792    3.2333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  9  1  0  0  0  0
  7  4  1  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  8  1  0  0  0  0
 11  3  1  0  0  0  0
 12  6  2  0  0  0  0
 13  6  2  0  0  0  0
 14 10  2  0  0  0  0
 15 11  2  0  0  0  0
 16 11  1  0  0  0  0
 17 10  1  0  0  0  0
 18 20  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  2  0  0  0  0
 21 18  1  0  0  0  0
 22 17  1  0  0  0  0
 23 22  1  0  0  0  0
 24 22  1  0  0  0  0
 25 24  1  0  0  0  0
 26 23  1  0  0  0  0
 27 25  1  0  0  0  0
  4  5  2  0  0  0  0
  6  7  1  0  0  0  0
 18 19  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,938)
2938

>  <Formula> (2,938)
C19H22FN3O3S

>  <MolWeight> (2,938)
391.4596832

>  <PCAT_CMPD_ID> (2,938)
WAY-277701

>  <CNC_ID> (2,938)
359342246

>  <transfer_container_id> (2,938)
PTN000000068

>  <COMPOUND_NUMBER> (2,938)
WAY-277701

>  <BAR_CODE_NO> (2,938)
390401

>  <LOCATION_CODE> (2,938)
PTNCS

>  <AMOUNT_CURRENT> (2,938)
32.5

$$$$
WAY-277762
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
   -3.1750    2.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8458    2.5708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8458    6.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6 11  1  0  0  0  0
  7  1  1  0  0  0  0
  8  5  1  0  0  0  0
  9  2  1  0  0  0  0
 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  2  0  0  0  0
 14  6  2  0  0  0  0
 15  6  2  0  0  0  0
 16  9  1  0  0  0  0
 17 12  1  0  0  0  0
 18 10  2  0  0  0  0
 19 12  2  0  0  0  0
 20 13  1  0  0  0  0
 21 17  1  0  0  0  0
 22 19  1  0  0  0  0
 23 16  2  0  0  0  0
 24 23  1  0  0  0  0
 25 13  1  0  0  0  0
 26 24  1  0  0  0  0
  5  4  2  0  0  0  0
  6  8  1  0  0  0  0
 21 22  2  0  0  0  0
 24 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,939)
2939

>  <Formula> (2,939)
C18H17N3O4S

>  <MolWeight> (2,939)
371.41028

>  <PCAT_CMPD_ID> (2,939)
WAY-277762

>  <CNC_ID> (2,939)
359342307

>  <transfer_container_id> (2,939)
PTN000000068

>  <COMPOUND_NUMBER> (2,939)
WAY-277762

>  <BAR_CODE_NO> (2,939)
390462

>  <LOCATION_CODE> (2,939)
PTNCS

>  <AMOUNT_CURRENT> (2,939)
32.5

$$$$
WAY-277776
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -3.2375    2.3333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2583    3.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  2  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  1  0  0  0  0
  9  7  2  0  0  0  0
 10 11  1  0  0  0  0
 11  4  1  0  0  0  0
 12  8  2  0  0  0  0
 13  5  1  0  0  0  0
 14  9  1  0  0  0  0
 15 14  1  0  0  0  0
 16  7  1  0  0  0  0
 17 16  2  0  0  0  0
 18  8  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
  5  3  2  0  0  0  0
 10 13  1  0  0  0  0
 19 14  2  0  0  0  0
M  END
>  <Mol_ID> (2,940)
2940

>  <Formula> (2,940)
C14H14ClN3OS

>  <MolWeight> (2,940)
307.79846

>  <PCAT_CMPD_ID> (2,940)
WAY-277776

>  <CNC_ID> (2,940)
359342321

>  <transfer_container_id> (2,940)
PTN000000068

>  <COMPOUND_NUMBER> (2,940)
WAY-277776

>  <BAR_CODE_NO> (2,940)
390476

>  <LOCATION_CODE> (2,940)
PTNCS

>  <AMOUNT_CURRENT> (2,940)
32.5

$$$$
WAY-277804
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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  4  1  2  0  0  0  0
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 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12  7  2  0  0  0  0
 13  9  2  0  0  0  0
 14 13  1  0  0  0  0
 15 17  1  0  0  0  0
 16  8  2  0  0  0  0
 17  4  1  0  0  0  0
 18 12  1  0  0  0  0
 19  6  1  0  0  0  0
 20 11  1  0  0  0  0
 21  7  1  0  0  0  0
 22 12  1  0  0  0  0
 23 21  2  0  0  0  0
 24 23  1  0  0  0  0
 25 18  1  0  0  0  0
  6  3  2  0  0  0  0
 15 19  1  0  0  0  0
 11 14  2  0  0  0  0
 24 18  2  0  0  0  0
M  END
>  <Mol_ID> (2,941)
2941

>  <Formula> (2,941)
C18H16BrN3O2S

>  <MolWeight> (2,941)
418.30754

>  <PCAT_CMPD_ID> (2,941)
WAY-277804

>  <CNC_ID> (2,941)
359342349

>  <transfer_container_id> (2,941)
PTN000000068

>  <COMPOUND_NUMBER> (2,941)
WAY-277804

>  <BAR_CODE_NO> (2,941)
390504

>  <LOCATION_CODE> (2,941)
PTNCS

>  <AMOUNT_CURRENT> (2,941)
32.5

$$$$
WAY-277822
csChFnd80/10111816222D

 26 29  0  0  0  0  0  0  0  0999 V2000
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  2  3  2  0  0  0  0
  3  1  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  6 10  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  1  0  0  0  0
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 10  8  1  0  0  0  0
 11  6  2  0  0  0  0
 12 18  1  0  0  0  0
 13  9  1  0  0  0  0
 14  4  1  0  0  0  0
 15  7  1  0  0  0  0
 16  7  1  0  0  0  0
 17  5  1  0  0  0  0
 18 16  1  0  0  0  0
 19 15  1  0  0  0  0
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  2  4  1  0  0  0  0
 22 14  2  0  0  0  0
 24 26  2  0  0  0  0
 12 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,942)
2942

>  <Formula> (2,942)
C21H22N2O2S

>  <MolWeight> (2,942)
366.47658

>  <PCAT_CMPD_ID> (2,942)
WAY-277822

>  <CNC_ID> (2,942)
359342367

>  <transfer_container_id> (2,942)
PTN000000068

>  <COMPOUND_NUMBER> (2,942)
WAY-277822

>  <BAR_CODE_NO> (2,942)
390522

>  <LOCATION_CODE> (2,942)
PTNCS

>  <AMOUNT_CURRENT> (2,942)
32.5

$$$$
WAY-277873
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  2  2  0  0  0  0
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 13  7  2  0  0  0  0
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 16  9  2  0  0  0  0
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 18 20  1  0  0  0  0
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  6  5  1  0  0  0  0
 19 18  2  0  0  0  0
 24 27  2  0  0  0  0
M  END
>  <Mol_ID> (2,943)
2943

>  <Formula> (2,943)
C18H17N3O5S

>  <MolWeight> (2,943)
387.40968

>  <PCAT_CMPD_ID> (2,943)
WAY-277873

>  <CNC_ID> (2,943)
359342418

>  <transfer_container_id> (2,943)
PTN000000068

>  <COMPOUND_NUMBER> (2,943)
WAY-277873

>  <BAR_CODE_NO> (2,943)
390573

>  <LOCATION_CODE> (2,943)
PTNCS

>  <AMOUNT_CURRENT> (2,943)
32.5

$$$$
WAY-277874
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  2  2  0  0  0  0
 12  7  1  0  0  0  0
 13  7  2  0  0  0  0
 14  4  1  0  0  0  0
 15  9  1  0  0  0  0
 16  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,944)
2944

>  <Formula> (2,944)
C18H17N3O5S

>  <MolWeight> (2,944)
387.40968

>  <PCAT_CMPD_ID> (2,944)
WAY-277874

>  <CNC_ID> (2,944)
359342419

>  <transfer_container_id> (2,944)
PTN000000068

>  <COMPOUND_NUMBER> (2,944)
WAY-277874

>  <BAR_CODE_NO> (2,944)
390574

>  <LOCATION_CODE> (2,944)
PTNCS

>  <AMOUNT_CURRENT> (2,944)
27.5

$$$$
WAY-277880
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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 10  3  2  0  0  0  0
 11  6  2  0  0  0  0
 12  1  1  0  0  0  0
 13 12  1  0  0  0  0
 14  8  1  0  0  0  0
 15 14  1  0  0  0  0
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 17 15  1  0  0  0  0
  9 13  1  0  0  0  0
  7  2  2  0  0  0  0
M  END
>  <Mol_ID> (2,945)
2945

>  <Formula> (2,945)
C11H15N3O2S

>  <MolWeight> (2,945)
253.3207

>  <PCAT_CMPD_ID> (2,945)
WAY-277880

>  <CNC_ID> (2,945)
359342425

>  <transfer_container_id> (2,945)
PTN000000068

>  <COMPOUND_NUMBER> (2,945)
WAY-277880

>  <BAR_CODE_NO> (2,945)
390580

>  <LOCATION_CODE> (2,945)
PTNCS

>  <AMOUNT_CURRENT> (2,945)
32.5

$$$$
WAY-277913
csChFnd80/10111816222D

 17 18  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,946)
2946

>  <Formula> (2,946)
C9H13N3O4S

>  <MolWeight> (2,946)
259.28222

>  <PCAT_CMPD_ID> (2,946)
WAY-277913

>  <CNC_ID> (2,946)
359342458

>  <transfer_container_id> (2,946)
PTN000000068

>  <COMPOUND_NUMBER> (2,946)
WAY-277913

>  <BAR_CODE_NO> (2,946)
390617

>  <LOCATION_CODE> (2,946)
PTNCS

>  <AMOUNT_CURRENT> (2,946)
32.5

$$$$
WAY-277917
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (2,947)
2947

>  <Formula> (2,947)
C24H27N3O3S

>  <MolWeight> (2,947)
437.55448

>  <PCAT_CMPD_ID> (2,947)
WAY-277917

>  <CNC_ID> (2,947)
359342462

>  <transfer_container_id> (2,947)
PTN000000068

>  <COMPOUND_NUMBER> (2,947)
WAY-277917

>  <BAR_CODE_NO> (2,947)
390621

>  <LOCATION_CODE> (2,947)
PTNCS

>  <AMOUNT_CURRENT> (2,947)
32.5

$$$$
WAY-277934
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    2.8000   -1.4542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
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  8  6  2  0  0  0  0
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 10  4  2  0  0  0  0
 11  5  1  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
 14  5  2  0  0  0  0
 15  2  2  0  0  0  0
 16  3  2  0  0  0  0
 17 12  2  0  0  0  0
 18 11  2  0  0  0  0
 19 13  2  0  0  0  0
 20 11  1  0  0  0  0
 21 13  1  0  0  0  0
 22  6  1  0  0  0  0
 23  7  1  0  0  0  0
 24  9  1  0  0  0  0
 25  8  1  0  0  0  0
 26 21  1  0  0  0  0
 27 20  1  0  0  0  0
 28 31  1  0  0  0  0
 29 30  1  0  0  0  0
 30 23  2  0  0  0  0
 31 22  2  0  0  0  0
  9  8  1  0  0  0  0
 17 14  1  0  0  0  0
 25 28  2  0  0  0  0
 29 24  2  0  0  0  0
M  END
>  <Mol_ID> (2,948)
2948

>  <Formula> (2,948)
C24H17NO6

>  <MolWeight> (2,948)
415.39488

>  <PCAT_CMPD_ID> (2,948)
WAY-277934

>  <CNC_ID> (2,948)
359342479

>  <transfer_container_id> (2,948)
PTN000000068

>  <COMPOUND_NUMBER> (2,948)
WAY-277934

>  <BAR_CODE_NO> (2,948)
390639

>  <LOCATION_CODE> (2,948)
PTNCS

>  <AMOUNT_CURRENT> (2,948)
32.5

$$$$
WAY-277984
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    3.2042   -0.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9167   -0.7792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4917   -0.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0625   -4.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3417   -4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  6  1  0  0  0  0
  6  9  1  0  0  0  0
  7  5  2  0  0  0  0
  8  4  1  0  0  0  0
  9 17  1  0  0  0  0
 10  2  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  2  0  0  0  0
 13  4  2  0  0  0  0
 14 13  1  0  0  0  0
 15  9  2  0  0  0  0
 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18 11  1  0  0  0  0
 19  3  2  0  0  0  0
 20  5  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  2  0  0  0  0
 23  7  1  0  0  0  0
 24 21  2  0  0  0  0
 25 22  1  0  0  0  0
 26 16  1  0  0  0  0
 27 18  1  0  0  0  0
 28 18  2  0  0  0  0
 29 27  2  0  0  0  0
 30 28  1  0  0  0  0
 31 30  2  0  0  0  0
  8 10  1  0  0  0  0
 13 24  1  0  0  0  0
 31 29  1  0  0  0  0
 25 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,949)
2949

>  <Formula> (2,949)
C26H26N2O3

>  <MolWeight> (2,949)
414.49624

>  <PCAT_CMPD_ID> (2,949)
WAY-277984

>  <CNC_ID> (2,949)
359342529

>  <transfer_container_id> (2,949)
PTN000000068

>  <COMPOUND_NUMBER> (2,949)
WAY-277984

>  <BAR_CODE_NO> (2,949)
390689

>  <LOCATION_CODE> (2,949)
PTNCS

>  <AMOUNT_CURRENT> (2,949)
32.5

$$$$
WAY-278001
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
    3.2042   -0.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9167   -0.8792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
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 10  2  1  0  0  0  0
 11  2  1  0  0  0  0
 12  1  2  0  0  0  0
 13  4  2  0  0  0  0
 14 13  1  0  0  0  0
 15  9  2  0  0  0  0
 16  7  1  0  0  0  0
 17 14  1  0  0  0  0
 18 11  1  0  0  0  0
 19  3  2  0  0  0  0
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 23 22  1  0  0  0  0
 24 21  2  0  0  0  0
 25  5  1  0  0  0  0
 26 19  1  0  0  0  0
 27 25  2  0  0  0  0
 28  7  1  0  0  0  0
 29 26  2  0  0  0  0
 30 27  1  0  0  0  0
 31 16  1  0  0  0  0
 32 20  1  0  0  0  0
  8 10  1  0  0  0  0
 29 13  1  0  0  0  0
 20 24  1  0  0  0  0
 30 16  2  0  0  0  0
M  END
>  <Mol_ID> (2,950)
2950

>  <Formula> (2,950)
C27H28N2O3

>  <MolWeight> (2,950)
428.52282

>  <PCAT_CMPD_ID> (2,950)
WAY-278001

>  <CNC_ID> (2,950)
359342546

>  <transfer_container_id> (2,950)
PTN000000068

>  <COMPOUND_NUMBER> (2,950)
WAY-278001

>  <BAR_CODE_NO> (2,950)
390706

>  <LOCATION_CODE> (2,950)
PTNCS

>  <AMOUNT_CURRENT> (2,950)
32.5

$$$$
WAY-278043
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
    3.4375   -1.4625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (2,951)
2951

>  <Formula> (2,951)
C21H21ClN4O4S

>  <MolWeight> (2,951)
460.93384

>  <PCAT_CMPD_ID> (2,951)
WAY-278043

>  <CNC_ID> (2,951)
359342588

>  <transfer_container_id> (2,951)
PTN000000068

>  <COMPOUND_NUMBER> (2,951)
WAY-278043

>  <BAR_CODE_NO> (2,951)
390748

>  <LOCATION_CODE> (2,951)
PTNCS

>  <AMOUNT_CURRENT> (2,951)
32.5

$$$$
WAY-278064
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,952)
2952

>  <Formula> (2,952)
C22H24N4O6S

>  <MolWeight> (2,952)
472.51416

>  <PCAT_CMPD_ID> (2,952)
WAY-278064

>  <CNC_ID> (2,952)
359342609

>  <transfer_container_id> (2,952)
PTN000000068

>  <COMPOUND_NUMBER> (2,952)
WAY-278064

>  <BAR_CODE_NO> (2,952)
390769

>  <LOCATION_CODE> (2,952)
PTNCS

>  <AMOUNT_CURRENT> (2,952)
32.5

$$$$
WAY-278065
csChFnd80/10111816222D

 31 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,953)
2953

>  <Formula> (2,953)
C20H20N4O6S

>  <MolWeight> (2,953)
444.461

>  <PCAT_CMPD_ID> (2,953)
WAY-278065

>  <CNC_ID> (2,953)
359342610

>  <transfer_container_id> (2,953)
PTN000000068

>  <COMPOUND_NUMBER> (2,953)
WAY-278065

>  <BAR_CODE_NO> (2,953)
390770

>  <LOCATION_CODE> (2,953)
PTNCS

>  <AMOUNT_CURRENT> (2,953)
32.5

$$$$
WAY-278119
csChFnd80/10111816222D

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M  END
>  <Mol_ID> (2,954)
2954

>  <Formula> (2,954)
C20H14Br2N2O3

>  <MolWeight> (2,954)
490.14476

>  <PCAT_CMPD_ID> (2,954)
WAY-278119

>  <CNC_ID> (2,954)
359342664

>  <transfer_container_id> (2,954)
PTN000000068

>  <COMPOUND_NUMBER> (2,954)
WAY-278119

>  <BAR_CODE_NO> (2,954)
390824

>  <LOCATION_CODE> (2,954)
PTNCS

>  <AMOUNT_CURRENT> (2,954)
32.5

$$$$
WAY-278188
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,955)
2955

>  <Formula> (2,955)
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>  <MolWeight> (2,955)
387.4031064

>  <PCAT_CMPD_ID> (2,955)
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>  <CNC_ID> (2,955)
359342733

>  <transfer_container_id> (2,955)
PTN000000068

>  <COMPOUND_NUMBER> (2,955)
WAY-278188

>  <BAR_CODE_NO> (2,955)
390893

>  <LOCATION_CODE> (2,955)
PTNCS

>  <AMOUNT_CURRENT> (2,955)
32.5

$$$$
WAY-278198
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  9  1  0  0  0  0
  7  1  1  0  0  0  0
  8  5  1  0  0  0  0
  9  2  1  0  0  0  0
 10  7  1  0  0  0  0
 11  3  1  0  0  0  0
 12  6  2  0  0  0  0
 13 10  2  0  0  0  0
 14 10  1  0  0  0  0
 15 14  1  0  0  0  0
 16 11  2  0  0  0  0
 17 11  1  0  0  0  0
 18 15  2  0  0  0  0
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 25 15  1  0  0  0  0
 26 24  1  0  0  0  0
 27 22  1  0  0  0  0
 28 23  1  0  0  0  0
  4  5  2  0  0  0  0
  8  6  1  0  0  0  0
 21 19  2  0  0  0  0
 22 26  2  0  0  0  0
M  END
>  <Mol_ID> (2,956)
2956

>  <Formula> (2,956)
C21H21N3O3S

>  <MolWeight> (2,956)
395.47474

>  <PCAT_CMPD_ID> (2,956)
WAY-278198

>  <CNC_ID> (2,956)
359342743

>  <transfer_container_id> (2,956)
PTN000000068

>  <COMPOUND_NUMBER> (2,956)
WAY-278198

>  <BAR_CODE_NO> (2,956)
390903

>  <LOCATION_CODE> (2,956)
PTNCS

>  <AMOUNT_CURRENT> (2,956)
32.5

$$$$
WAY-278214
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
   -3.2708    2.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0958    2.5458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6 10  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  5  1  0  0  0  0
 10  3  1  0  0  0  0
 11  7  1  0  0  0  0
 12  6  2  0  0  0  0
 13  8  2  0  0  0  0
 14 11  2  0  0  0  0
 15  8  1  0  0  0  0
 16 11  1  0  0  0  0
 17 13  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  2  0  0  0  0
 20 19  1  0  0  0  0
  4  5  2  0  0  0  0
  9  6  1  0  0  0  0
 18 20  2  0  0  0  0
M  END
>  <Mol_ID> (2,957)
2957

>  <Formula> (2,957)
C14H15N3O2S

>  <MolWeight> (2,957)
289.3528

>  <PCAT_CMPD_ID> (2,957)
WAY-278214

>  <CNC_ID> (2,957)
359342759

>  <transfer_container_id> (2,957)
PTN000000068

>  <COMPOUND_NUMBER> (2,957)
WAY-278214

>  <BAR_CODE_NO> (2,957)
390919

>  <LOCATION_CODE> (2,957)
PTNCS

>  <AMOUNT_CURRENT> (2,957)
32.5

$$$$
WAY-278234
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
   -3.2708    2.5458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7 10  1  0  0  0  0
  8  6  1  0  0  0  0
  9  5  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12  7  2  0  0  0  0
 13  8  2  0  0  0  0
 14 11  2  0  0  0  0
 15 11  1  0  0  0  0
 16  8  1  0  0  0  0
 17 18  1  0  0  0  0
 18 15  2  0  0  0  0
 19 14  1  0  0  0  0
 20 17  1  0  0  0  0
 21 16  1  0  0  0  0
 22 16  1  0  0  0  0
 23 20  1  0  0  0  0
 24 22  1  0  0  0  0
 25 21  1  0  0  0  0
  4  5  2  0  0  0  0
  9  7  1  0  0  0  0
 19 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,958)
2958

>  <Formula> (2,958)
C18H23N3O3S

>  <MolWeight> (2,958)
361.45852

>  <PCAT_CMPD_ID> (2,958)
WAY-278234

>  <CNC_ID> (2,958)
359342779

>  <transfer_container_id> (2,958)
PTN000000068

>  <COMPOUND_NUMBER> (2,958)
WAY-278234

>  <BAR_CODE_NO> (2,958)
390939

>  <LOCATION_CODE> (2,958)
PTNCS

>  <AMOUNT_CURRENT> (2,958)
32.5

$$$$
WAY-278266
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
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  7 10  1  0  0  0  0
  8  6  1  0  0  0  0
  9  5  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 12  8  1  0  0  0  0
 13  7  2  0  0  0  0
 14  8  2  0  0  0  0
 15 12  2  0  0  0  0
 16 12  1  0  0  0  0
 17 19  1  0  0  0  0
 18 15  1  0  0  0  0
 19 16  2  0  0  0  0
 20 17  1  0  0  0  0
 21 11  1  0  0  0  0
 22 11  1  0  0  0  0
 23 11  1  0  0  0  0
  4  5  2  0  0  0  0
  9  7  1  0  0  0  0
 18 17  2  0  0  0  0
M  END
>  <Mol_ID> (2,959)
2959

>  <Formula> (2,959)
C16H18BrN3O2S

>  <MolWeight> (2,959)
396.30202

>  <PCAT_CMPD_ID> (2,959)
WAY-278266

>  <CNC_ID> (2,959)
359342811

>  <transfer_container_id> (2,959)
PTN000000068

>  <COMPOUND_NUMBER> (2,959)
WAY-278266

>  <BAR_CODE_NO> (2,959)
390971

>  <LOCATION_CODE> (2,959)
PTNCS

>  <AMOUNT_CURRENT> (2,959)
32.5

$$$$
WAY-278271
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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  8 11  1  0  0  0  0
  9  7  1  0  0  0  0
 10  5  1  0  0  0  0
 11  2  1  0  0  0  0
 12  3  1  0  0  0  0
 13  8  2  0  0  0  0
 14  9  2  0  0  0  0
 15  7  2  0  0  0  0
 16 14  1  0  0  0  0
 17  9  1  0  0  0  0
 18 12  1  0  0  0  0
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 22 17  2  0  0  0  0
 23 22  1  0  0  0  0
  4  5  2  0  0  0  0
 10  8  1  0  0  0  0
 21 23  2  0  0  0  0
M  END
>  <Mol_ID> (2,960)
2960

>  <Formula> (2,960)
C16H18FN3O2S

>  <MolWeight> (2,960)
335.3964232

>  <PCAT_CMPD_ID> (2,960)
WAY-278271

>  <CNC_ID> (2,960)
359342816

>  <transfer_container_id> (2,960)
PTN000000068

>  <COMPOUND_NUMBER> (2,960)
WAY-278271

>  <BAR_CODE_NO> (2,960)
390976

>  <LOCATION_CODE> (2,960)
PTNCS

>  <AMOUNT_CURRENT> (2,960)
32.5

$$$$
WAY-278296
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  7 11  1  0  0  0  0
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 10  5  1  0  0  0  0
 11  2  1  0  0  0  0
 12  3  1  0  0  0  0
 13 15  1  0  0  0  0
 14  8  1  0  0  0  0
 15 14  2  0  0  0  0
 16  7  2  0  0  0  0
 17  8  2  0  0  0  0
 18  9  1  0  0  0  0
 19  9  1  0  0  0  0
 20  9  1  0  0  0  0
 21 23  1  0  0  0  0
 22 14  1  0  0  0  0
 23 22  2  0  0  0  0
 24 12  1  0  0  0  0
 25 12  1  0  0  0  0
 26 12  1  0  0  0  0
  4  5  2  0  0  0  0
 10  7  1  0  0  0  0
 13 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,961)
2961

>  <Formula> (2,961)
C17H18F3N3O2S

>  <MolWeight> (2,961)
385.4039296

>  <PCAT_CMPD_ID> (2,961)
WAY-278296

>  <CNC_ID> (2,961)
359342841

>  <transfer_container_id> (2,961)
PTN000000068

>  <COMPOUND_NUMBER> (2,961)
WAY-278296

>  <BAR_CODE_NO> (2,961)
391001

>  <LOCATION_CODE> (2,961)
PTNCS

>  <AMOUNT_CURRENT> (2,961)
32.5

$$$$
WAY-335217
csChFnd80/10111816222D

 32 35  0  0  0  0  0  0  0  0999 V2000
   -3.8708    3.8000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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  2  5  1  0  0  0  0
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 10 23  1  0  0  0  0
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 12  1  2  0  0  0  0
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 14 24  1  0  0  0  0
 15  8  1  0  0  0  0
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 26  6  1  0  0  0  0
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 10  2  2  0  0  0  0
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 20 17  1  0  0  0  0
 19  9  2  0  0  0  0
M  END
>  <Mol_ID> (2,962)
2962

>  <Formula> (2,962)
C21H15ClF2N2O5S

>  <MolWeight> (2,962)
480.8690064

>  <PCAT_CMPD_ID> (2,962)
WAY-335217

>  <CNC_ID> (2,962)
359344478

>  <transfer_container_id> (2,962)
PTN000000068

>  <COMPOUND_NUMBER> (2,962)
WAY-335217

>  <BAR_CODE_NO> (2,962)
310218

>  <LOCATION_CODE> (2,962)
PTNCS

>  <AMOUNT_CURRENT> (2,962)
32.5

$$$$
WAY-335280
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  0  0  0  0
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 10  6  1  0  0  0  0
 11  9  1  0  0  0  0
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 13 12  2  0  0  0  0
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 15 18  2  0  0  0  0
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 17  5  1  0  0  0  0
 18 14  1  0  0  0  0
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 20  7  1  0  0  0  0
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 15 13  1  0  0  0  0
M  END
>  <Mol_ID> (2,963)
2963

>  <Formula> (2,963)
C14H12ClFN4

>  <MolWeight> (2,963)
290.7232832

>  <PCAT_CMPD_ID> (2,963)
WAY-335280

>  <CNC_ID> (2,963)
359344541

>  <transfer_container_id> (2,963)
PTN000000068

>  <COMPOUND_NUMBER> (2,963)
WAY-335280

>  <BAR_CODE_NO> (2,963)
310281

>  <LOCATION_CODE> (2,963)
PTNCS

>  <AMOUNT_CURRENT> (2,963)
32.5

$$$$
WAY-628601
csChFnd80/10111816222D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10 15  2  0  0  0  0
 13 16  1  0  0  0  0
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  5  8  1  0  0  0  0
  9 11  2  0  0  0  0
 12 15  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,964)
2964

>  <Formula> (2,964)
C18H19N3O2

>  <MolWeight> (2,964)
309.36236

>  <PCAT_CMPD_ID> (2,964)
WAY-628601

>  <CNC_ID> (2,964)
359349752

>  <transfer_container_id> (2,964)
PTN000000068

>  <COMPOUND_NUMBER> (2,964)
WAY-628601

>  <BAR_CODE_NO> (2,964)
90462859

>  <LOCATION_CODE> (2,964)
PTNCS

>  <AMOUNT_CURRENT> (2,964)
32.7

$$$$
WAY-628605
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 15  5  1  0  0  0  0
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 16 11  1  0  0  0  0
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M  END
>  <Mol_ID> (2,965)
2965

>  <Formula> (2,965)
C18H22N2O3S2

>  <MolWeight> (2,965)
378.50888

>  <PCAT_CMPD_ID> (2,965)
WAY-628605

>  <CNC_ID> (2,965)
359349756

>  <transfer_container_id> (2,965)
PTN000000068

>  <COMPOUND_NUMBER> (2,965)
WAY-628605

>  <BAR_CODE_NO> (2,965)
90462863

>  <LOCATION_CODE> (2,965)
PTNCS

>  <AMOUNT_CURRENT> (2,965)
32.5

$$$$
WAY-628616
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10 11  2  0  0  0  0
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 17  9  1  0  0  0  0
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 20  8  1  0  0  0  0
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 12 18  1  0  0  0  0
 16 22  1  0  0  0  0
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M  END
>  <Mol_ID> (2,966)
2966

>  <Formula> (2,966)
C19H19N3O2

>  <MolWeight> (2,966)
321.37306

>  <PCAT_CMPD_ID> (2,966)
WAY-628616

>  <CNC_ID> (2,966)
359349767

>  <transfer_container_id> (2,966)
PTN000000068

>  <COMPOUND_NUMBER> (2,966)
WAY-628616

>  <BAR_CODE_NO> (2,966)
90462876

>  <LOCATION_CODE> (2,966)
PTNCS

>  <AMOUNT_CURRENT> (2,966)
32.1

$$$$
WAY-628635
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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 10  9  1  0  0  0  0
 11  4  1  0  0  0  0
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 15 12  2  0  0  0  0
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 17 14  2  0  0  0  0
 18 16  2  0  0  0  0
 18 17  1  0  0  0  0
  8 10  2  0  0  0  0
M  END
>  <Mol_ID> (2,967)
2967

>  <Formula> (2,967)
C14H16N2OS

>  <MolWeight> (2,967)
260.35464

>  <PCAT_CMPD_ID> (2,967)
WAY-628635

>  <CNC_ID> (2,967)
359349786

>  <transfer_container_id> (2,967)
PTN000000068

>  <COMPOUND_NUMBER> (2,967)
WAY-628635

>  <BAR_CODE_NO> (2,967)
90462896

>  <LOCATION_CODE> (2,967)
PTNCS

>  <AMOUNT_CURRENT> (2,967)
32.8

$$$$
WAY-628650
csChFnd80/10111816222D

 23 25  0  0  0  0  0  0  0  0999 V2000
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 23 20  2  0  0  0  0
  6  3  1  0  0  0  0
 11  9  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,968)
2968

>  <Formula> (2,968)
C17H18N2O3S

>  <MolWeight> (2,968)
330.40142

>  <PCAT_CMPD_ID> (2,968)
WAY-628650

>  <CNC_ID> (2,968)
359349801

>  <transfer_container_id> (2,968)
PTN000000068

>  <COMPOUND_NUMBER> (2,968)
WAY-628650

>  <BAR_CODE_NO> (2,968)
90462911

>  <LOCATION_CODE> (2,968)
PTNCS

>  <AMOUNT_CURRENT> (2,968)
32.8

$$$$
WAY-628726
csChFnd80/10111816222D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 11  8  1  0  0  0  0
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 22  3  1  0  0  0  0
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  3  4  1  0  0  0  0
  9 10  1  0  0  0  0
 32 31  1  0  0  0  0
 29 25  2  0  0  0  0
 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,969)
2969

>  <Formula> (2,969)
C25H20N4O2S

>  <MolWeight> (2,969)
440.5169

>  <PCAT_CMPD_ID> (2,969)
WAY-628726

>  <CNC_ID> (2,969)
359349877

>  <transfer_container_id> (2,969)
PTN000000068

>  <COMPOUND_NUMBER> (2,969)
WAY-628726

>  <BAR_CODE_NO> (2,969)
90462989

>  <LOCATION_CODE> (2,969)
PTNCS

>  <AMOUNT_CURRENT> (2,969)
32.8

$$$$
WAY-628840
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
   -0.1125    1.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (2,970)
2970

>  <Formula> (2,970)
C18H22FNO4

>  <MolWeight> (2,970)
335.3699832

>  <PCAT_CMPD_ID> (2,970)
WAY-628840

>  <CNC_ID> (2,970)
359349991

>  <transfer_container_id> (2,970)
PTN000000068

>  <COMPOUND_NUMBER> (2,970)
WAY-628840

>  <BAR_CODE_NO> (2,970)
90463112

>  <LOCATION_CODE> (2,970)
PTNCS

>  <AMOUNT_CURRENT> (2,970)
32.1

$$$$
WAY-628841
csChFnd80/10111816222D

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  2  1  1  0  0  0  0
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  8  6  1  0  0  0  0
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 10  3  2  0  0  0  0
 11 19  1  0  0  0  0
 12  5  1  0  0  0  0
 13  7  2  0  0  0  0
 14  5  1  0  0  0  0
 15 13  1  0  0  0  0
 16 13  1  0  0  0  0
 17  4  1  0  0  0  0
 18  4  1  0  0  0  0
 19 18  1  0  0  0  0
 20 17  1  0  0  0  0
 21 15  1  0  0  0  0
 12 16  2  0  0  0  0
 11 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,971)
2971

>  <Formula> (2,971)
C14H16ClNO4S

>  <MolWeight> (2,971)
329.79914

>  <PCAT_CMPD_ID> (2,971)
WAY-628841

>  <CNC_ID> (2,971)
359349992

>  <transfer_container_id> (2,971)
PTN000000068

>  <COMPOUND_NUMBER> (2,971)
WAY-628841

>  <BAR_CODE_NO> (2,971)
90463113

>  <LOCATION_CODE> (2,971)
PTNCS

>  <AMOUNT_CURRENT> (2,971)
32.6

$$$$
WAY-628842
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11 14  1  0  0  0  0
 12  2  1  0  0  0  0
 13  2  1  0  0  0  0
 14 13  1  0  0  0  0
 15 12  1  0  0  0  0
 16  9  1  0  0  0  0
 17  9  2  0  0  0  0
 18 10  2  0  0  0  0
 19 10  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  2  0  0  0  0
 23 16  2  0  0  0  0
 24 22  1  0  0  0  0
 25 20  2  0  0  0  0
 11 15  1  0  0  0  0
 24 21  2  0  0  0  0
 25 23  1  0  0  0  0
M  END
>  <Mol_ID> (2,972)
2972

>  <Formula> (2,972)
C20H21NO4

>  <MolWeight> (2,972)
339.38504

>  <PCAT_CMPD_ID> (2,972)
WAY-628842

>  <CNC_ID> (2,972)
359349993

>  <transfer_container_id> (2,972)
PTN000000068

>  <COMPOUND_NUMBER> (2,972)
WAY-628842

>  <BAR_CODE_NO> (2,972)
90463114

>  <LOCATION_CODE> (2,972)
PTNCS

>  <AMOUNT_CURRENT> (2,972)
32.4

$$$$
WAY-628893
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
 11  3  2  0  0  0  0
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 13  8  1  0  0  0  0
 14  8  1  0  0  0  0
 15  7  2  0  0  0  0
 16  9  2  0  0  0  0
 17 14  1  0  0  0  0
 18 13  1  0  0  0  0
 19  9  1  0  0  0  0
 20  4  1  0  0  0  0
 21  5  1  0  0  0  0
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 23 21  2  0  0  0  0
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  4  5  2  0  0  0  0
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 12 18  1  0  0  0  0
M  END
>  <Mol_ID> (2,973)
2973

>  <Formula> (2,973)
C18H20N2O5

>  <MolWeight> (2,973)
344.3618

>  <PCAT_CMPD_ID> (2,973)
WAY-628893

>  <CNC_ID> (2,973)
359350044

>  <transfer_container_id> (2,973)
PTN000000068

>  <COMPOUND_NUMBER> (2,973)
WAY-628893

>  <BAR_CODE_NO> (2,973)
90463165

>  <LOCATION_CODE> (2,973)
PTNCS

>  <AMOUNT_CURRENT> (2,973)
32

$$$$
WAY-628992
csChFnd80/10111816222D

 25 27  0  0  0  0  0  0  0  0999 V2000
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 10  1  2  0  0  0  0
 11  2  2  0  0  0  0
 12  6  2  0  0  0  0
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 14  9  2  0  0  0  0
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 16 13  2  0  0  0  0
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 23 16  1  0  0  0  0
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 25 22  2  0  0  0  0
  2  4  1  0  0  0  0
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 25 21  1  0  0  0  0
M  END
>  <Mol_ID> (2,974)
2974

>  <Formula> (2,974)
C19H16N2O4

>  <MolWeight> (2,974)
336.34134

>  <PCAT_CMPD_ID> (2,974)
WAY-628992

>  <CNC_ID> (2,974)
359350143

>  <transfer_container_id> (2,974)
PTN000000068

>  <COMPOUND_NUMBER> (2,974)
WAY-628992

>  <BAR_CODE_NO> (2,974)
90463266

>  <LOCATION_CODE> (2,974)
PTNCS

>  <AMOUNT_CURRENT> (2,974)
32.7

$$$$
WAY-628994
csChFnd80/10111816222D

 21 22  0  0  0  0  0  0  0  0999 V2000
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 20 21  2  0  0  0  0
M  END
>  <Mol_ID> (2,975)
2975

>  <Formula> (2,975)
C16H14N2O3

>  <MolWeight> (2,975)
282.29396

>  <PCAT_CMPD_ID> (2,975)
WAY-628994

>  <CNC_ID> (2,975)
359350145

>  <transfer_container_id> (2,975)
PTN000000068

>  <COMPOUND_NUMBER> (2,975)
WAY-628994

>  <BAR_CODE_NO> (2,975)
90463269

>  <LOCATION_CODE> (2,975)
PTNCS

>  <AMOUNT_CURRENT> (2,975)
33

$$$$
WAY-629032
csChFnd80/10111816222D

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 10  7  1  0  0  0  0
 11  8  2  0  0  0  0
 12  9  2  0  0  0  0
 13  1  2  0  0  0  0
 14  1  2  0  0  0  0
 15 16  2  0  0  0  0
 16  4  1  0  0  0  0
 17 24  1  0  0  0  0
 18  5  1  0  0  0  0
 19  5  1  0  0  0  0
 20 10  1  0  0  0  0
 21 10  1  0  0  0  0
 22  8  1  0  0  0  0
 23  9  1  0  0  0  0
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 17 25  1  0  0  0  0
  7  3  2  0  0  0  0
 11 12  1  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (2,976)
2976

>  <Formula> (2,976)
C20H27N3O3S

>  <MolWeight> (2,976)
389.51168

>  <PCAT_CMPD_ID> (2,976)
WAY-629032

>  <CNC_ID> (2,976)
359350183

>  <transfer_container_id> (2,976)
PTN000000068

>  <COMPOUND_NUMBER> (2,976)
WAY-629032

>  <BAR_CODE_NO> (2,976)
90463308

>  <LOCATION_CODE> (2,976)
PTNCS

>  <AMOUNT_CURRENT> (2,976)
32.4

$$$$
WAY-629119
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  5  2  0  0  0  0
 11  7  2  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14  7  1  0  0  0  0
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 16 13  2  0  0  0  0
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 19  9  1  0  0  0  0
 20  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,977)
2977

>  <Formula> (2,977)
C20H20N2O4

>  <MolWeight> (2,977)
352.3838

>  <PCAT_CMPD_ID> (2,977)
WAY-629119

>  <CNC_ID> (2,977)
359350269

>  <transfer_container_id> (2,977)
PTN000000068

>  <COMPOUND_NUMBER> (2,977)
WAY-629119

>  <BAR_CODE_NO> (2,977)
90463400

>  <LOCATION_CODE> (2,977)
PTNCS

>  <AMOUNT_CURRENT> (2,977)
32.7

$$$$
WAY-629159
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 13 15  1  0  0  0  0
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 18 20  1  0  0  0  0
  5  7  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Mol_ID> (2,978)
2978

>  <Formula> (2,978)
C14H20N2O4

>  <MolWeight> (2,978)
280.3196

>  <PCAT_CMPD_ID> (2,978)
WAY-629159

>  <CNC_ID> (2,978)
359350309

>  <transfer_container_id> (2,978)
PTN000000068

>  <COMPOUND_NUMBER> (2,978)
WAY-629159

>  <BAR_CODE_NO> (2,978)
90463441

>  <LOCATION_CODE> (2,978)
PTNCS

>  <AMOUNT_CURRENT> (2,978)
33

$$$$
WAY-629195
csChFnd80/10111816222D

 24 27  0  0  0  0  0  0  0  0999 V2000
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 10  9  2  0  0  0  0
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 13  2  1  0  0  0  0
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 11 13  2  0  0  0  0
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M  END
>  <Mol_ID> (2,979)
2979

>  <Formula> (2,979)
C17H15N5OS

>  <MolWeight> (2,979)
337.3989

>  <PCAT_CMPD_ID> (2,979)
WAY-629195

>  <CNC_ID> (2,979)
359350345

>  <transfer_container_id> (2,979)
PTN000000068

>  <COMPOUND_NUMBER> (2,979)
WAY-629195

>  <BAR_CODE_NO> (2,979)
90463481

>  <LOCATION_CODE> (2,979)
PTNCS

>  <AMOUNT_CURRENT> (2,979)
32.9

$$$$
WAY-629203
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 16 14  2  0  0  0  0
 20 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,980)
2980

>  <Formula> (2,980)
C13H9Cl2N5OS

>  <MolWeight> (2,980)
354.21446

>  <PCAT_CMPD_ID> (2,980)
WAY-629203

>  <CNC_ID> (2,980)
359350353

>  <transfer_container_id> (2,980)
PTN000000068

>  <COMPOUND_NUMBER> (2,980)
WAY-629203

>  <BAR_CODE_NO> (2,980)
90463489

>  <LOCATION_CODE> (2,980)
PTNCS

>  <AMOUNT_CURRENT> (2,980)
32.6

$$$$
WAY-629204
csChFnd80/10111816222D

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 10  9  2  0  0  0  0
 11  6  1  0  0  0  0
 12  7  1  0  0  0  0
 13  6  2  0  0  0  0
 14 11  1  0  0  0  0
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 20  9  1  0  0  0  0
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 10  8  1  0  0  0  0
  4  3  1  0  0  0  0
 17 19  1  0  0  0  0
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M  END
>  <Mol_ID> (2,981)
2981

>  <Formula> (2,981)
C19H24ClN5OS

>  <MolWeight> (2,981)
405.94476

>  <PCAT_CMPD_ID> (2,981)
WAY-629204

>  <CNC_ID> (2,981)
359350354

>  <transfer_container_id> (2,981)
PTN000000068

>  <COMPOUND_NUMBER> (2,981)
WAY-629204

>  <BAR_CODE_NO> (2,981)
90463491

>  <LOCATION_CODE> (2,981)
PTNCS

>  <AMOUNT_CURRENT> (2,981)
32.8

$$$$
WAY-629233
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
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 10 14  1  0  0  0  0
 11  1  2  0  0  0  0
 12  1  1  0  0  0  0
 13  2  2  0  0  0  0
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 15  4  2  0  0  0  0
 16  9  2  0  0  0  0
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M  END
>  <Mol_ID> (2,982)
2982

>  <Formula> (2,982)
C20H24O6

>  <MolWeight> (2,982)
360.40096

>  <PCAT_CMPD_ID> (2,982)
WAY-629233

>  <CNC_ID> (2,982)
359350383

>  <transfer_container_id> (2,982)
PTN000000068

>  <COMPOUND_NUMBER> (2,982)
WAY-629233

>  <BAR_CODE_NO> (2,982)
90463520

>  <LOCATION_CODE> (2,982)
PTNCS

>  <AMOUNT_CURRENT> (2,982)
32.4

$$$$
WAY-629234
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10  7  2  0  0  0  0
 11  9  1  0  0  0  0
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 14  4  1  0  0  0  0
 15  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,983)
2983

>  <Formula> (2,983)
C15H17NO4

>  <MolWeight> (2,983)
275.29978

>  <PCAT_CMPD_ID> (2,983)
WAY-629234

>  <CNC_ID> (2,983)
359350384

>  <transfer_container_id> (2,983)
PTN000000068

>  <COMPOUND_NUMBER> (2,983)
WAY-629234

>  <BAR_CODE_NO> (2,983)
90463521

>  <LOCATION_CODE> (2,983)
PTNCS

>  <AMOUNT_CURRENT> (2,983)
32.3

$$$$
WAY-629256
csChFnd80/10111816222D

 19 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,984)
2984

>  <Formula> (2,984)
C14H10N2O2S

>  <MolWeight> (2,984)
270.3064

>  <PCAT_CMPD_ID> (2,984)
WAY-629256

>  <CNC_ID> (2,984)
359350406

>  <transfer_container_id> (2,984)
PTN000000068

>  <COMPOUND_NUMBER> (2,984)
WAY-629256

>  <BAR_CODE_NO> (2,984)
90463544

>  <LOCATION_CODE> (2,984)
PTNCS

>  <AMOUNT_CURRENT> (2,984)
32.5

$$$$
WAY-629274
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 10  6  2  0  0  0  0
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M  END
>  <Mol_ID> (2,985)
2985

>  <Formula> (2,985)
C12H21N5OS

>  <MolWeight> (2,985)
283.39304

>  <PCAT_CMPD_ID> (2,985)
WAY-629274

>  <CNC_ID> (2,985)
359350424

>  <transfer_container_id> (2,985)
PTN000000068

>  <COMPOUND_NUMBER> (2,985)
WAY-629274

>  <BAR_CODE_NO> (2,985)
90463562

>  <LOCATION_CODE> (2,985)
PTNCS

>  <AMOUNT_CURRENT> (2,985)
32.6

$$$$
WAY-629309
csChFnd80/10111816222D

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 23 24  1  0  0  0  0
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M  END
>  <Mol_ID> (2,986)
2986

>  <Formula> (2,986)
C18H13N5O3S

>  <MolWeight> (2,986)
379.39252

>  <PCAT_CMPD_ID> (2,986)
WAY-629309

>  <CNC_ID> (2,986)
359350459

>  <transfer_container_id> (2,986)
PTN000000068

>  <COMPOUND_NUMBER> (2,986)
WAY-629309

>  <BAR_CODE_NO> (2,986)
90463599

>  <LOCATION_CODE> (2,986)
PTNCS

>  <AMOUNT_CURRENT> (2,986)
32.8

$$$$
WAY-629318
csChFnd80/10111816222D

 26 28  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
 11  4  1  0  0  0  0
 12  9  1  0  0  0  0
 13  7  2  0  0  0  0
 14  8  1  0  0  0  0
 15  8  2  0  0  0  0
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 22  3  1  0  0  0  0
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M  END
>  <Mol_ID> (2,987)
2987

>  <Formula> (2,987)
C18H22N2O4S2

>  <MolWeight> (2,987)
394.50828

>  <PCAT_CMPD_ID> (2,987)
WAY-629318

>  <CNC_ID> (2,987)
359350468

>  <transfer_container_id> (2,987)
PTN000000068

>  <COMPOUND_NUMBER> (2,987)
WAY-629318

>  <BAR_CODE_NO> (2,987)
90463609

>  <LOCATION_CODE> (2,987)
PTNCS

>  <AMOUNT_CURRENT> (2,987)
32.5

$$$$
WAY-629330
csChFnd80/10111816222D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 11  6  2  0  0  0  0
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 13  8  2  0  0  0  0
 14  4  1  0  0  0  0
 15  9  2  0  0  0  0
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  2  5  1  0  0  0  0
 12  7  2  0  0  0  0
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M  END
>  <Mol_ID> (2,988)
2988

>  <Formula> (2,988)
C16H14N2O2

>  <MolWeight> (2,988)
266.29456

>  <PCAT_CMPD_ID> (2,988)
WAY-629330

>  <CNC_ID> (2,988)
359350480

>  <transfer_container_id> (2,988)
PTN000000068

>  <COMPOUND_NUMBER> (2,988)
WAY-629330

>  <BAR_CODE_NO> (2,988)
90463622

>  <LOCATION_CODE> (2,988)
PTNCS

>  <AMOUNT_CURRENT> (2,988)
33

$$$$
WAY-629340
csChFnd80/10111816222D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10  2  2  0  0  0  0
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 15  3  1  0  0  0  0
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 18  6  2  0  0  0  0
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 15 21  2  0  0  0  0
 12 13  2  0  0  0  0
M  END
>  <Mol_ID> (2,989)
2989

>  <Formula> (2,989)
C15H14ClNO4S

>  <MolWeight> (2,989)
339.79396

>  <PCAT_CMPD_ID> (2,989)
WAY-629340

>  <CNC_ID> (2,989)
359350490

>  <transfer_container_id> (2,989)
PTN000000068

>  <COMPOUND_NUMBER> (2,989)
WAY-629340

>  <BAR_CODE_NO> (2,989)
90463632

>  <LOCATION_CODE> (2,989)
PTNCS

>  <AMOUNT_CURRENT> (2,989)
32.3

$$$$
WAY-629354
csChFnd80/10111816222D

 24 26  0  0  0  0  0  0  0  0999 V2000
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 10  7  1  0  0  0  0
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 18  4  2  0  0  0  0
 19  6  2  0  0  0  0
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 21  5  1  0  0  0  0
 22  8  1  0  0  0  0
 23  4  1  0  0  0  0
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M  END
>  <Mol_ID> (2,990)
2990

>  <Formula> (2,990)
C17H22N2O5

>  <MolWeight> (2,990)
334.36698

>  <PCAT_CMPD_ID> (2,990)
WAY-629354

>  <CNC_ID> (2,990)
359350504

>  <transfer_container_id> (2,990)
PTN000000068

>  <COMPOUND_NUMBER> (2,990)
WAY-629354

>  <BAR_CODE_NO> (2,990)
90463646

>  <LOCATION_CODE> (2,990)
PTNCS

>  <AMOUNT_CURRENT> (2,990)
32.8

$$$$
WAY-629379
csChFnd80/10111816222D

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 10  4  1  0  0  0  0
 11  7  1  0  0  0  0
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 13 14  1  0  0  0  0
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 15 13  1  0  0  0  0
 16  2  1  0  0  0  0
 17  5  1  0  0  0  0
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M  END
>  <Mol_ID> (2,991)
2991

>  <Formula> (2,991)
C22H29N3O2

>  <MolWeight> (2,991)
367.48456

>  <PCAT_CMPD_ID> (2,991)
WAY-629379

>  <CNC_ID> (2,991)
359350529

>  <transfer_container_id> (2,991)
PTN000000068

>  <COMPOUND_NUMBER> (2,991)
WAY-629379

>  <BAR_CODE_NO> (2,991)
90463671

>  <LOCATION_CODE> (2,991)
PTNCS

>  <AMOUNT_CURRENT> (2,991)
32.8

$$$$
WAY-629385
csChFnd80/10111816222D

 27 30  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  6  2  0  0  0  0
 12  4  2  0  0  0  0
 13  5  2  0  0  0  0
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 16  2  1  0  0  0  0
 17  2  1  0  0  0  0
 18  3  1  0  0  0  0
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 20  9  1  0  0  0  0
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M  END
>  <Mol_ID> (2,992)
2992

>  <Formula> (2,992)
C22H22FNO3

>  <MolWeight> (2,992)
367.4133832

>  <PCAT_CMPD_ID> (2,992)
WAY-629385

>  <CNC_ID> (2,992)
359350535

>  <transfer_container_id> (2,992)
PTN000000068

>  <COMPOUND_NUMBER> (2,992)
WAY-629385

>  <BAR_CODE_NO> (2,992)
90463677

>  <LOCATION_CODE> (2,992)
PTNCS

>  <AMOUNT_CURRENT> (2,992)
32.5

$$$$
WAY-629389
csChFnd80/10111816222D

 19 20  0  0  0  0  0  0  0  0999 V2000
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 10  4  2  0  0  0  0
 11  7  2  0  0  0  0
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 13  8  1  0  0  0  0
 14  3  1  0  0  0  0
 15  9  1  0  0  0  0
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  6  3  2  0  0  0  0
 17 19  1  0  0  0  0
M  END
>  <Mol_ID> (2,993)
2993

>  <Formula> (2,993)
C12H14BrNO5

>  <MolWeight> (2,993)
332.14726

>  <PCAT_CMPD_ID> (2,993)
WAY-629389

>  <CNC_ID> (2,993)
359350539

>  <transfer_container_id> (2,993)
PTN000000068

>  <COMPOUND_NUMBER> (2,993)
WAY-629389

>  <BAR_CODE_NO> (2,993)
90463682

>  <LOCATION_CODE> (2,993)
PTNCS

>  <AMOUNT_CURRENT> (2,993)
32.8

$$$$
WAY-629396
csChFnd80/10111816222D

 27 29  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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M  END
>  <Mol_ID> (2,994)
2994

>  <Formula> (2,994)
C18H14ClFN2O5

>  <MolWeight> (2,994)
392.7655632

>  <PCAT_CMPD_ID> (2,994)
WAY-629396

>  <CNC_ID> (2,994)
359350546

>  <transfer_container_id> (2,994)
PTN000000068

>  <COMPOUND_NUMBER> (2,994)
WAY-629396

>  <BAR_CODE_NO> (2,994)
90463689

>  <LOCATION_CODE> (2,994)
PTNCS

>  <AMOUNT_CURRENT> (2,994)
32.5

$$$$
WAY-629432
csChFnd80/10111816222D

 22 25  0  0  0  0  0  0  0  0999 V2000
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  5  7  2  0  0  0  0
  3  2  1  0  0  0  0
 20  8  2  0  0  0  0
M  END
>  <Mol_ID> (2,995)
2995

>  <Formula> (2,995)
C15H10N2O3S2

>  <MolWeight> (2,995)
330.3815

>  <PCAT_CMPD_ID> (2,995)
WAY-629432

>  <CNC_ID> (2,995)
359350582

>  <transfer_container_id> (2,995)
PTN000000068

>  <COMPOUND_NUMBER> (2,995)
WAY-629432

>  <BAR_CODE_NO> (2,995)
90463730

>  <LOCATION_CODE> (2,995)
PTNCS

>  <AMOUNT_CURRENT> (2,995)
32.3

$$$$
WAY-629434
csChFnd80/10111816222D

 20 21  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  5  2  0  0  0  0
 13 12  1  0  0  0  0
 14 11  2  0  0  0  0
 15 13  2  0  0  0  0
 16  9  1  0  0  0  0
 17 10  1  0  0  0  0
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 20 18  1  0  0  0  0
 15 14  1  0  0  0  0
 18 16  1  0  0  0  0
M  END
>  <Mol_ID> (2,996)
2996

>  <Formula> (2,996)
C14H20N2O3S

>  <MolWeight> (2,996)
296.3852

>  <PCAT_CMPD_ID> (2,996)
WAY-629434

>  <CNC_ID> (2,996)
359350584

>  <transfer_container_id> (2,996)
PTN000000068

>  <COMPOUND_NUMBER> (2,996)
WAY-629434

>  <BAR_CODE_NO> (2,996)
90463732

>  <LOCATION_CODE> (2,996)
PTNCS

>  <AMOUNT_CURRENT> (2,996)
32.8

$$$$
WAY-629529-A
csChFnd80/10111816222D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 11  5  1  0  0  0  0
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 24 11  1  0  0  0  0
 25 23  1  0  0  0  0
  6  8  2  0  0  0  0
 21 20  1  0  0  0  0
  9 15  1  0  0  0  0
 10  7  1  0  0  0  0
M  END
>  <Mol_ID> (2,997)
2997

>  <Formula> (2,997)
C19H18N4O2

>  <MolWeight> (2,997)
334.37182

>  <PCAT_CMPD_ID> (2,997)
WAY-629529-A

>  <CNC_ID> (2,997)
359350679

>  <transfer_container_id> (2,997)
PTN000000076

>  <COMPOUND_NUMBER> (2,997)
WAY-629529-A

>  <BAR_CODE_NO> (2,997)
90611010

>  <LOCATION_CODE> (2,997)
PTNCS

>  <AMOUNT_CURRENT> (2,997)
32.6

$$$$
WAY-629533
csChFnd80/10111816222D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 14  9  1  0  0  0  0
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  5  4  1  0  0  0  0
 17 21  2  0  0  0  0
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M  END
>  <Mol_ID> (2,998)
2998

>  <Formula> (2,998)
C16H14N2O3S

>  <MolWeight> (2,998)
314.35896

>  <PCAT_CMPD_ID> (2,998)
WAY-629533

>  <CNC_ID> (2,998)
359350683

>  <transfer_container_id> (2,998)
PTN000000068

>  <COMPOUND_NUMBER> (2,998)
WAY-629533

>  <BAR_CODE_NO> (2,998)
90463836

>  <LOCATION_CODE> (2,998)
PTNCS

>  <AMOUNT_CURRENT> (2,998)
32.7

$$$$
WAY-629547
csChFnd80/10111816222D

 18 19  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (2,999)
2999

>  <Formula> (2,999)
C13H13NO3S

>  <MolWeight> (2,999)
263.31222

>  <PCAT_CMPD_ID> (2,999)
WAY-629547

>  <CNC_ID> (2,999)
359350697

>  <transfer_container_id> (2,999)
PTN000000068

>  <COMPOUND_NUMBER> (2,999)
WAY-629547

>  <BAR_CODE_NO> (2,999)
90463854

>  <LOCATION_CODE> (2,999)
PTNCS

>  <AMOUNT_CURRENT> (2,999)
32.9

$$$$
WAY-629609
csChFnd80/10111816222D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (3,000)
3000

>  <Formula> (3,000)
C20H19N5O3

>  <MolWeight> (3,000)
377.39656

>  <PCAT_CMPD_ID> (3,000)
WAY-629609

>  <CNC_ID> (3,000)
359350759

>  <transfer_container_id> (3,000)
PTN000000068

>  <COMPOUND_NUMBER> (3,000)
WAY-629609

>  <BAR_CODE_NO> (3,000)
90463917

>  <LOCATION_CODE> (3,000)
PTNCS

>  <AMOUNT_CURRENT> (3,000)
32.5

$$$$
